Receptor
PDB id Resolution Class Description Source Keywords
2FC2 2.2 Å EC: 1.14.13.165 NO-HEME COMPLEX IN A BACTERIAL NITRIC OXIDE SYNTHASE. AN FE(III)-NO MAY CAUSE NITROSATION. BACILLUS SUBTILIS N-NITROSATION NO-HEME COMPLEX NITRIC OXIDE SYNTHASE OXIDOREDUCTASE
Ref.: NITROSYL-HEME STRUCTURES OF BACILLUS SUBTILIS NITRIC OXIDE SYNTHASE HAVE IMPLICATIONS FOR UNDERSTANDING SUBSTRATE OXIDATION. BIOCHEMISTRY V. 45 2537 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
HAR A:909;
A:910;
Valid;
Valid;
none;
none;
submit data
190.2 C6 H14 N4 O3 C(C[C...
HBI A:903;
B:904;
Valid;
Valid;
none;
none;
submit data
239.231 C9 H13 N5 O3 C[C@@...
HEM A:901;
B:902;
Part of Protein;
Part of Protein;
none;
none;
submit data
616.487 C34 H32 Fe N4 O4 Cc1c2...
NO A:1901;
B:1902;
B:2903;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
30.006 N O [N]=O
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4LWA 2.06 Å EC: 1.14.13.165 STRUCTURE OF BACILLUS SUBTILIS NITRIC OXIDE SYNTHASE IN COMP ((2S, 3S)-1,3-BIS((6-(2,5-DIMETHYL-1H-PYRROL-1-YL)-4-METHYLY L)METHOXY)-2-AMINOBUTANE BACILLUS SUBTILIS SUBSP. SUBTILIS NITRIC OXIDE SYNTHASE OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITCOMPLEX
Ref.: STRUCTURAL AND BIOLOGICAL STUDIES ON BACTERIAL NITR SYNTHASE INHIBITORS. PROC.NATL.ACAD.SCI.USA V. 110 18127 2013
Members (73)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5G6E - H4B C9 H15 N5 O3 C[C@@H]([C....
2 4UG9 - 1EW C25 H33 N5 Cc1cc(nc(c....
3 4UGH - H4B C9 H15 N5 O3 C[C@@H]([C....
4 2FBZ - HAR C6 H14 N4 O3 C(C[C@@H](....
5 5G6B - M48 C19 H20 F N3 c1cc(cc(c1....
6 4D3V - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
7 5G6N - 8VJ C19 H21 N3 O CN(C)Cc1cc....
8 4UG5 - XFK C21 H25 N5 Cc1cc(nc(c....
9 4UGR - 6E5 C29 H31 N5 O2 S2 [H]/N=C(/c....
10 5G6K - M94 C19 H21 N3 O CNCCc1cccc....
11 4UG8 - HW1 C22 H33 N5 O Cc1cc(nc(c....
12 4UGG - S5D C22 H27 N5 Cc1cc(nc(c....
13 4D7I - 0GD C21 H22 F N3 Cc1cc(nc(c....
14 5G6O - 8VJ C19 H21 N3 O CN(C)Cc1cc....
15 4UGQ - 7LN C27 H29 N5 O2 S2 c1cc(cc(c1....
16 4UGW - HW1 C22 H33 N5 O Cc1cc(nc(c....
17 5G6F - 2SN C19 H22 N4 CN(C)Cc1cc....
18 5G6L - XEB C18 H18 Cl N3 O CNCc1cc(cc....
19 5G69 - H4B C9 H15 N5 O3 C[C@@H]([C....
20 4UGS - H36 C24 H22 N4 O2 S2 [H]/N=C(Nc....
21 5G6C - H4B C9 H15 N5 O3 C[C@@H]([C....
22 4UGC - 1Q6 C17 H25 N5 O2 Cc1cc(nc(c....
23 4UGE - H4B C9 H15 N5 O3 C[C@@H]([C....
24 4D3K - 12S C25 H33 N5 Cc1cc(nc(c....
25 4UG7 - 1EV C23 H25 N5 Cc1cc(nc(c....
26 4UGT - UGT C16 H19 N3 O S c1cc(cc(c1....
27 4UGF - Q16 C19 H27 N5 O2 Cc1cc(nc(c....
28 4LWB Kd = 4.4 uM QJ8 C19 H27 N5 O2 Cc1cc(nc(c....
29 4UG6 - H4B C9 H15 N5 O3 C[C@@H]([C....
30 5G6D - JHT C19 H22 N4 CN(C)c1ccc....
31 4D7J - 0GD C21 H22 F N3 Cc1cc(nc(c....
32 4UGY - H4B C9 H15 N5 O3 C[C@@H]([C....
33 5G6A - H4B C9 H15 N5 O3 C[C@@H]([C....
34 1M7V - THG C19 H23 N7 O6 c1cc(ccc1C....
35 2FC2 - HBI C9 H13 N5 O3 C[C@@H]([C....
36 4D3J - XFN C22 H27 N5 Cc1cc(nc(c....
37 5G6M - 9M9 C17 H17 N3 O c1cc(cc(c1....
38 4UQR - H4B C9 H15 N5 O3 C[C@@H]([C....
39 4UGL - S90 C20 H27 F N4 Cc1cc(nc(c....
40 4UGM - H4B C9 H15 N5 O3 C[C@@H]([C....
41 4D3O - S97 C24 H27 N5 Cc1cc(nc(c....
42 4UGA - Q05 C22 H24 F N3 O Cc1cc(nc(c....
43 5G6J - M94 C19 H21 N3 O CNCCc1cccc....
44 4UGP - H4B C9 H15 N5 O3 C[C@@H]([C....
45 4UGV - H4B C9 H15 N5 O3 C[C@@H]([C....
46 5G66 - M5K C10 H10 N2 Cc1cc(nc2c....
47 4D3I - 1ET C23 H29 N5 Cc1cc(nc(c....
48 4UGK - 7S9 C17 H24 N4 Cc1cc(nc(c....
49 4D3N - SK6 C22 H23 N5 Cc1cc(nc(c....
50 4D3U - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
51 4UGN - H49 C17 H22 N4 S c1cc(cc(c1....
52 5G67 - M87 C18 H18 F N3 c1cc(cc(c1....
53 5G6Q - TUE C17 H16 N4 O C=NCc1cc(c....
54 4UGX - 5H4 C22 H24 F N3 S [H]/N=C(c1....
55 4D3M - IVU C24 H27 N5 Cc1cc(nc(c....
56 4UGJ - H4B C9 H15 N5 O3 C[C@@H]([C....
57 2FC1 - HBI C9 H13 N5 O3 C[C@@H]([C....
58 5G6P - 8VJ C19 H21 N3 O CN(C)Cc1cc....
59 4UGO - 1QF C27 H29 N5 S2 [H]/N=C(c1....
60 5G6G - M85 C18 H19 N3 O CNCc1cccc(....
61 4D7H - M46 C20 H22 F N3 c1cc(cc(c1....
62 4UQS - INE C7 H4 Br N3 O2 c1cc2c(c(c....
63 5G68 - ML6 C19 H20 F N3 c1cc(cc(c1....
64 1M7Z - THG C19 H23 N7 O6 c1cc(ccc1C....
65 4UGB - QJ7 C21 H23 F N4 O Cc1cc(nc(c....
66 4UGD - Q14 C18 H27 N5 O2 Cc1cc(nc(c....
67 5G6I - H4B C9 H15 N5 O3 C[C@@H]([C....
68 4D3T - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
69 5G65 - 2AQ C9 H8 N2 c1ccc2c(c1....
70 5G6H - H4B C9 H15 N5 O3 C[C@@H]([C....
71 4UGI - SKO C17 H25 N5 Cc1cc(nc(c....
72 4LWA Kd = 1.1 uM Q13 C18 H27 N5 O2 Cc1cc(nc(c....
73 4UGU - PQW C27 H27 N5 O2 S2 [H]/N=C(/c....
70% Homology Family (73)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5G6E - H4B C9 H15 N5 O3 C[C@@H]([C....
2 4UG9 - 1EW C25 H33 N5 Cc1cc(nc(c....
3 4UGH - H4B C9 H15 N5 O3 C[C@@H]([C....
4 2FBZ - HAR C6 H14 N4 O3 C(C[C@@H](....
5 5G6B - M48 C19 H20 F N3 c1cc(cc(c1....
6 4D3V - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
7 5G6N - 8VJ C19 H21 N3 O CN(C)Cc1cc....
8 4UG5 - XFK C21 H25 N5 Cc1cc(nc(c....
9 4UGR - 6E5 C29 H31 N5 O2 S2 [H]/N=C(/c....
10 5G6K - M94 C19 H21 N3 O CNCCc1cccc....
11 4UG8 - HW1 C22 H33 N5 O Cc1cc(nc(c....
12 4UGG - S5D C22 H27 N5 Cc1cc(nc(c....
13 4D7I - 0GD C21 H22 F N3 Cc1cc(nc(c....
14 5G6O - 8VJ C19 H21 N3 O CN(C)Cc1cc....
15 4UGQ - 7LN C27 H29 N5 O2 S2 c1cc(cc(c1....
16 4UGW - HW1 C22 H33 N5 O Cc1cc(nc(c....
17 5G6F - 2SN C19 H22 N4 CN(C)Cc1cc....
18 5G6L - XEB C18 H18 Cl N3 O CNCc1cc(cc....
19 5G69 - H4B C9 H15 N5 O3 C[C@@H]([C....
20 4UGS - H36 C24 H22 N4 O2 S2 [H]/N=C(Nc....
21 5G6C - H4B C9 H15 N5 O3 C[C@@H]([C....
22 4UGC - 1Q6 C17 H25 N5 O2 Cc1cc(nc(c....
23 4UGE - H4B C9 H15 N5 O3 C[C@@H]([C....
24 4D3K - 12S C25 H33 N5 Cc1cc(nc(c....
25 4UG7 - 1EV C23 H25 N5 Cc1cc(nc(c....
26 4UGT - UGT C16 H19 N3 O S c1cc(cc(c1....
27 4UGF - Q16 C19 H27 N5 O2 Cc1cc(nc(c....
28 4LWB Kd = 4.4 uM QJ8 C19 H27 N5 O2 Cc1cc(nc(c....
29 4UG6 - H4B C9 H15 N5 O3 C[C@@H]([C....
30 5G6D - JHT C19 H22 N4 CN(C)c1ccc....
31 4D7J - 0GD C21 H22 F N3 Cc1cc(nc(c....
32 4UGY - H4B C9 H15 N5 O3 C[C@@H]([C....
33 5G6A - H4B C9 H15 N5 O3 C[C@@H]([C....
34 1M7V - THG C19 H23 N7 O6 c1cc(ccc1C....
35 2FC2 - HBI C9 H13 N5 O3 C[C@@H]([C....
36 4D3J - XFN C22 H27 N5 Cc1cc(nc(c....
37 5G6M - 9M9 C17 H17 N3 O c1cc(cc(c1....
38 4UQR - H4B C9 H15 N5 O3 C[C@@H]([C....
39 4UGL - S90 C20 H27 F N4 Cc1cc(nc(c....
40 4UGM - H4B C9 H15 N5 O3 C[C@@H]([C....
41 4D3O - S97 C24 H27 N5 Cc1cc(nc(c....
42 4UGA - Q05 C22 H24 F N3 O Cc1cc(nc(c....
43 5G6J - M94 C19 H21 N3 O CNCCc1cccc....
44 4UGP - H4B C9 H15 N5 O3 C[C@@H]([C....
45 4UGV - H4B C9 H15 N5 O3 C[C@@H]([C....
46 5G66 - M5K C10 H10 N2 Cc1cc(nc2c....
47 4D3I - 1ET C23 H29 N5 Cc1cc(nc(c....
48 4UGK - 7S9 C17 H24 N4 Cc1cc(nc(c....
49 4D3N - SK6 C22 H23 N5 Cc1cc(nc(c....
50 4D3U - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
51 4UGN - H49 C17 H22 N4 S c1cc(cc(c1....
52 5G67 - M87 C18 H18 F N3 c1cc(cc(c1....
53 5G6Q - TUE C17 H16 N4 O C=NCc1cc(c....
54 4UGX - 5H4 C22 H24 F N3 S [H]/N=C(c1....
55 4D3M - IVU C24 H27 N5 Cc1cc(nc(c....
56 4UGJ - H4B C9 H15 N5 O3 C[C@@H]([C....
57 2FC1 - HBI C9 H13 N5 O3 C[C@@H]([C....
58 5G6P - 8VJ C19 H21 N3 O CN(C)Cc1cc....
59 4UGO - 1QF C27 H29 N5 S2 [H]/N=C(c1....
60 5G6G - M85 C18 H19 N3 O CNCc1cccc(....
61 4D7H - M46 C20 H22 F N3 c1cc(cc(c1....
62 4UQS - INE C7 H4 Br N3 O2 c1cc2c(c(c....
63 5G68 - ML6 C19 H20 F N3 c1cc(cc(c1....
64 1M7Z - THG C19 H23 N7 O6 c1cc(ccc1C....
65 4UGB - QJ7 C21 H23 F N4 O Cc1cc(nc(c....
66 4UGD - Q14 C18 H27 N5 O2 Cc1cc(nc(c....
67 5G6I - H4B C9 H15 N5 O3 C[C@@H]([C....
68 4D3T - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
69 5G65 - 2AQ C9 H8 N2 c1ccc2c(c1....
70 5G6H - H4B C9 H15 N5 O3 C[C@@H]([C....
71 4UGI - SKO C17 H25 N5 Cc1cc(nc(c....
72 4LWA Kd = 1.1 uM Q13 C18 H27 N5 O2 Cc1cc(nc(c....
73 4UGU - PQW C27 H27 N5 O2 S2 [H]/N=C(/c....
50% Homology Family (500)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4UPR Ki = 16.68 uM 7LN C27 H29 N5 O2 S2 c1cc(cc(c1....
2 1FOJ - 7NI C7 H5 N3 O2 c1cc2cn[nH....
3 3N6A - H4B C9 H15 N5 O3 C[C@@H]([C....
4 1ED5 - NRG C6 H13 N5 O4 [H]/N=C(NC....
5 5UO9 Ki = 43 uM 8J4 C20 H23 N3 O CCc1cc(cc(....
6 1Q2O Ki = 9.5 uM DP1 C10 H22 N8 O4 C(C[C@@H](....
7 4D36 Ki = 8.1 uM HLW C18 H20 Cl N5 c1cc(cc(c1....
8 1DM7 - HRG C7 H16 N4 O2 C(CCNC(=N)....
9 5NSE - HAR C6 H14 N4 O3 C(C[C@@H](....
10 3NLF Ki = 18.78 uM JRS C21 H29 F N4 O Cc1cc(nc(c....
11 4CWW Ki = 45.2 uM HW9 C22 H32 N4 O Cc1ccnc(c1....
12 1M9K Kd ~ 250 uM 7NI C7 H5 N3 O2 c1cc2cn[nH....
13 3N67 - H4B C9 H15 N5 O3 C[C@@H]([C....
14 4UHA Ki = 24950 nM S49 C29 H33 N5 O4 S [H]/N=C(/c....
15 1FOP - ARG C6 H15 N4 O2 C(C[C@@H](....
16 4D1P - H4B C9 H15 N5 O3 C[C@@H]([C....
17 5VVD - H4B C9 H15 N5 O3 C[C@@H]([C....
18 3JWZ Ki = 57100 nM J14 C21 H30 F N5 Cc1cc(nc(c....
19 4CU0 Ki = 68520 nM S71 C22 H28 N6 Cc1cc(nc(c....
20 3N6E - H4B C9 H15 N5 O3 C[C@@H]([C....
21 4NSE - ARG C6 H15 N4 O2 C(C[C@@H](....
22 4D34 Ki = 10.5 uM E2Z C17 H18 F N5 c1cc(cc(c1....
23 1FOI - 14W C10 H15 N3 [H]/N=C(/C....
24 5FVY - H4B C9 H15 N5 O3 C[C@@H]([C....
25 4IMX Ki = 26.4 uM 1EV C23 H25 N5 Cc1cc(nc(c....
26 5ADM - 9M9 C17 H17 N3 O c1cc(cc(c1....
27 2G6O - ARG C6 H15 N4 O2 C(C[C@@H](....
28 3JWY Ki = 34500 nM J11 C21 H30 F N5 Cc1cc(nc(c....
29 4K5I Ki = 15213 nM 1Q7 C17 H25 N5 O2 Cc1cc(nc(c....
30 5FJ2 - XEB C18 H18 Cl N3 O CNCc1cc(cc....
31 4CWZ - H4B C9 H15 N5 O3 C[C@@H]([C....
32 4CVG - ARG C6 H15 N4 O2 C(C[C@@H](....
33 1D1W Ki = 0.35 uM ATQ C3 H6 N2 S C1CSC(=N1)....
34 4D39 Ki = 10.5 uM OLW C17 H16 N6 c1cc(cc(c1....
35 1ZZS Ki = 5.1 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
36 4UPS Ki = 3.63 uM 6E5 C29 H31 N5 O2 S2 [H]/N=C(/c....
37 5VV8 Ki = 0.092 uM 9P7 C20 H20 N4 Cc1cc(ccc1....
38 4KCQ Ki = 41.4 uM 1QF C27 H29 N5 S2 [H]/N=C(c1....
39 4JSK Ki = 979 nM QJ2 C17 H24 N4 Cc1cc(nc(c....
40 5ADL - H4B C9 H15 N5 O3 C[C@@H]([C....
41 9NSE Ki = 0.039 uM ISU C3 H8 N2 Se [H]/N=C(/N....
42 3DQS Ki = 85.2 uM JI3 C20 H28 Cl N5 Cc1cc(nc(c....
43 5VV9 Ki = 1.22 uM 9OG C20 H20 N4 Cc1cc(nc2c....
44 4CUN - ARG C6 H15 N4 O2 C(C[C@@H](....
45 1P6N Ki = 110 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
46 5FVZ Ki = 16637 nM W67 C18 H26 N4 Cc1cc(nc(c....
47 4CUM - WS7 C11 H15 N5 O CC12CCCCC1....
48 1D1V - H4B C9 H15 N5 O3 C[C@@H]([C....
49 4KCS Ki = 21.7 uM 5H4 C22 H24 F N3 S [H]/N=C(c1....
50 4K5K Ki = 2542 nM Q13 C18 H27 N5 O2 Cc1cc(nc(c....
51 4CWY Ki = 26.1 uM HW1 C22 H33 N5 O Cc1cc(nc(c....
52 3NLG Ki = 36.19 uM JSR C21 H29 F N4 O Cc1cc(nc(c....
53 3NSE - ARG C6 H15 N4 O2 C(C[C@@H](....
54 4UPQ Ki = 12.44 uM I5U C27 H29 N5 O2 S2 [H]/N=C(c1....
55 1D1Y - 3BT C12 H18 N4 S2 [H]/N=C(N)....
56 1DMK - AP6 C12 H14 N6 c1ccc(cc1)....
57 4D37 Ki = 4 uM 9HL C19 H20 F N5 c1cc(cc(c1....
58 4UH7 Ki = 20240 nM 4V4 C18 H26 N4 Cc1cc(nc(c....
59 3N5P Ki = 20000 nM XFM C21 H25 N5 Cc1cc(nc(c....
60 3NLD Ki = 26.2 uM JSS C21 H29 F N4 O Cc1cc(nc(c....
61 4CX2 - H2B C9 H13 N5 O3 C[C@@H]([C....
62 4CAR Ki = 0.485 uM M87 C18 H18 F N3 c1cc(cc(c1....
63 4JSL Ki = 2154 nM QJ4 C19 H28 N4 Cc1cc(nc(c....
64 6NSE - GGB C5 H12 N4 O3 [H]/N=C(N)....
65 5VVB - 9P7 C20 H20 N4 Cc1cc(ccc1....
66 4K5H Ki = 26446 nM 1Q6 C17 H25 N5 O2 Cc1cc(nc(c....
67 4C3A Ki = 6727 nM Q16 C19 H27 N5 O2 Cc1cc(nc(c....
68 5UOB Ki = 16.1 uM M4R C22 H24 N4 O Cc1cc(nc2c....
69 1M9J Kd ~ 0.6 uM CLW C7 H4 Cl N O2 c1cc2c(cc1....
70 1FOL - ARG C6 H15 N4 O2 C(C[C@@H](....
71 1D0O - INE C7 H4 Br N3 O2 c1cc2c(c(c....
72 5VV6 Ki = 1.57 uM P64 C20 H24 N4 CN(C)c1ccc....
73 4JSM Ki = 10366 nM QJ7 C21 H23 F N4 O Cc1cc(nc(c....
74 4UH8 Ki = 12910 nM EXI C17 H25 N5 Cc1cc(nc(c....
75 4CX1 - H2B C9 H13 N5 O3 C[C@@H]([C....
76 1P6L Ki = 107 uM DP1 C10 H22 N8 O4 C(C[C@@H](....
77 1NSE - H4B C9 H15 N5 O3 C[C@@H]([C....
78 4KCR Ki = 0.9 uM 5H3 C20 H20 F N3 S [H]/N=C(c1....
79 5VVC - 9OJ C21 H22 N4 Cc1cc(ccc1....
80 1ED6 - ILO C7 H15 N3 O2 CC(=N)NCCC....
81 1RS8 - DP2 C12 H28 N8 O4 C(CCN)C[C@....
82 3NLI - H4B C9 H15 N5 O3 C[C@@H]([C....
83 7NSE - DA2 C8 H18 N4 O2 [H]/N=C(/N....
84 1DM6 - PH3 C7 H8 Cl N3 O c1cc(ccc1N....
85 5UOA Ki = 5.63 uM 8EY C20 H20 N4 O Cc1cc(nc2c....
86 5ADN - H4B C9 H15 N5 O3 C[C@@H]([C....
87 3N6F - H4B C9 H15 N5 O3 C[C@@H]([C....
88 4UH9 Ki = 30238 nM S85 C18 H25 F N4 Cc1cc(nc(c....
89 1DMJ - AP4 C8 H9 N5 O3 C1[C@@H]2C....
90 2NSE - H4B C9 H15 N5 O3 C[C@@H]([C....
91 1D1X - H4B C9 H15 N5 O3 C[C@@H]([C....
92 4LUW Kd = 2.1 uM QJ8 C19 H27 N5 O2 Cc1cc(nc(c....
93 3NOS - HAR C6 H14 N4 O3 C(C[C@@H](....
94 3EAH ic50 = 0.04 uM 327 C10 H14 N2 O S [H]/N=C/1c....
95 4D35 Ki = 4 uM 4E8 C18 H20 F N5 c1cc(cc(c1....
96 1D0C - INE C7 H4 Br N3 O2 c1cc2c(c(c....
97 4CWV Ki = 148.9 uM HW8 C21 H30 N4 O Cc1cc(nc(c....
98 4K5J Ki = 20196 nM Q14 C18 H27 N5 O2 Cc1cc(nc(c....
99 1P6M Ki = 80 uM DP3 C8 H21 N7 O2 C(C[C@@H](....
100 5UO8 Ki = 12.3 uM 8EV C19 H18 N4 O CNCc1cc(cc....
101 4CUL - ARG C6 H15 N4 O2 C(C[C@@H](....
102 4D3A Ki = 15.4 uM 7F5 C19 H22 F N5 Cc1cncn1c2....
103 5UOD - 8EY C20 H20 N4 O Cc1cc(nc2c....
104 5VVG Ki = 0.115 uM 9PM C19 H17 Cl N4 c1cc(cc2c1....
105 1FOO - ARG C6 H15 N4 O2 C(C[C@@H](....
106 1M9Q - 5NI C7 H5 N3 O2 c1cc2c(cc1....
107 3PNH Ki = 19 uM 8CX C21 H28 F2 N4 O Cc1cc(nc(c....
108 4D1O - ARG C6 H15 N4 O2 C(C[C@@H](....
109 4D38 Ki = 10.32 uM L5Z C19 H20 F N5 c1cc(cc(c1....
110 5FJ3 Ki = 12.5 uM XEB C18 H18 Cl N3 O CNCc1cc(cc....
111 5VVN Ki = 0.581 uM P94 C19 H18 N4 c1cc(ccc1C....
112 1DM8 - H4B C9 H15 N5 O3 C[C@@H]([C....
113 4D33 Ki = 40 uM 6J0 C17 H19 F N6 c1cc(cc(c1....
114 5UOC Ki = 22.2 uM 8FD C22 H24 N4 O Cc1cc(nc2c....
115 2HX2 Ki = 73 uM 3HX C8 H21 N7 O3 [H]/N=C(/N....
116 1I83 - NTU C18 H38 N4 S2 CS/C(=NCCC....
117 1ED4 Ki = 0.022 uM IPU C4 H10 N2 S CC(C)SC(=N....
118 5VV7 Ki = 1.04 uM XH8 C18 H20 N4 c1cc(cnc1)....
119 4KCP Ki = 2.7 uM H44 C25 H25 N5 S2 [H]/N=C(/c....
120 1RS9 - D7P C15 H25 N7 O4 c1ccc(cc1)....
121 4UPT Ki = 3.34 uM PQW C27 H27 N5 O2 S2 [H]/N=C(/c....
122 4CX0 - H4B C9 H15 N5 O3 C[C@@H]([C....
123 1M9M - 6NI C7 H5 N3 O2 c1cc2cn[nH....
124 3JWX Ki = 20300 nM JI5 C21 H30 F N5 Cc1cc(nc(c....
125 4CTZ Ki = 328000 nM S7K C22 H26 N4 Cc1ccnc(c1....
126 5ADK - H4B C9 H15 N5 O3 C[C@@H]([C....
127 3N5S Ki = 16100 nM XFK C21 H25 N5 Cc1cc(nc(c....
128 1ZZT Ki = 1.1 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
129 3JWW Ki = 26400 nM JI4 C21 H30 F N5 Cc1cc(nc(c....
130 4CTY Ki = 14390 nM S5D C22 H27 N5 Cc1cc(nc(c....
131 5ADJ - M94 C19 H21 N3 O CNCCc1cccc....
132 3N6G - H4B C9 H15 N5 O3 C[C@@H]([C....
133 3NLE Ki = 19.2 uM JRR C21 H29 F N4 O Cc1cc(nc(c....
134 8NSE - H4B C9 H15 N5 O3 C[C@@H]([C....
135 1DMI - BHS C9 H15 N5 O3 C[C@H]([C@....
136 3NLH - H4B C9 H15 N5 O3 C[C@@H]([C....
137 4CWX Ki = 33.5 uM HW0 C21 H31 N5 O Cc1cc(nc(c....
138 1DWV - HAR C6 H14 N4 O3 C(C[C@@H](....
139 2ORS - 391 C21 H16 N4 O4 Cc1cc(nc(n....
140 1M8D Kd ~ 4.3 uM CLW C7 H4 Cl N O2 c1cc2c(cc1....
141 1DF1 - ITU C3 H8 N2 S CCSC(=N)N
142 2NOS - AGU C H6 N4 C(=N)(N)NN
143 1R35 ic50 = 6.09 uM I58 C8 H16 F N3 O2 [H]/N=C(/C....
144 2ORR - 333 C20 H14 N4 O4 c1cc(ccc1n....
145 1DD7 ic50 = 28 nM 1PM C23 H25 N7 O5 COC(=O)N1C....
146 3NQS - H4B NO n/a n/a
147 2ORO ic50 = 0.29 nM 228 C22 H24 N6 O3 Cc1cc(nc(n....
148 3EAI ic50 = 0.074 uM 328 C19 H20 N4 O2 COc1ccnc(c....
149 1N2N - H4B C9 H15 N5 O3 C[C@@H]([C....
150 1M9T - H4B C9 H15 N5 O3 C[C@@H]([C....
151 2ORP ic50 = 1.9 nM R86 C27 H35 N7 O3 Cc1cc(nc(n....
152 3EBF ic50 = 0.4 uM 332 C17 H19 N3 O2 S c1cc2c(cc1....
153 1QW4 - H4B C9 H15 N5 O3 C[C@@H]([C....
154 1JWK - HBI C9 H13 N5 O3 C[C@@H]([C....
155 2ORQ - MR1 C8 H9 N O2 c1cc2c(cc1....
156 3E6N ic50 = 0.015 uM AS3 C9 H14 N2 CCCc1cc(cc....
157 3E65 ic50 = 0.13 uM XXZ C20 H22 F N5 O c1cc2c(c(c....
158 3E6T ic50 = 1.2 uM 1A2 C21 H22 F2 N6 O CCN1c2c(cc....
159 3E7M - H4B C9 H15 N5 O3 C[C@@H]([C....
160 1DWW - HAR C6 H14 N4 O3 C(C[C@@H](....
161 3E68 ic50 = 0.12 uM AT6 C16 H16 N4 O Cc1cc(nc(c....
162 3E6L ic50 = 0.72 uM A11 C13 H18 Cl N3 O2 CCOC(=O)N1....
163 3EBD ic50 = 0.04 uM 329 C8 H10 N2 O S C[C@H]1CN=....
164 2ORT - 342 C22 H23 N3 O3 c1cc(ccc1n....
165 5UNZ Ki = 0.061 uM M4R C22 H24 N4 O Cc1cc(nc2c....
166 4UGZ Ki = 130 nM 4V4 C18 H26 N4 Cc1cc(nc(c....
167 3NLP - H4B C9 H15 N5 O3 C[C@@H]([C....
168 4JSE Ki = 48 nM QJ2 C17 H24 N4 Cc1cc(nc(c....
169 1ZZR Ki = 42 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
170 3NLW Ki = 2.7 uM 3XF C20 H33 F2 N5 O Cc1cc(nc(c....
171 4CTX Ki = 70 nM 71S C22 H28 N6 Cc1cc(nc(c....
172 4D7O Ki = 525 nM 0GD C21 H22 F N3 Cc1cc(nc(c....
173 4CAQ Ki = 0.066 uM M68 C19 H20 Cl N3 c1cc(cc(c1....
174 3N5Y Ki = 99 nM XFL C21 H25 N5 Cc1cc(nc(c....
175 5UNS Ki = 0.054 uM 8J4 C20 H23 N3 O CCc1cc(cc(....
176 5FVW Ki = 13 nM W66 C17 H24 N4 Cc1cc(nc(c....
177 5VUT Ki = 0.019 uM 9OG C20 H20 N4 Cc1cc(nc2c....
178 2HX3 Ki = 0.12 uM 3HX C8 H21 N7 O3 [H]/N=C(/N....
179 3JX3 Ki = 180 nM JI5 C21 H30 F N5 Cc1cc(nc(c....
180 4UPN Ki = 0.0147 uM 7LN C27 H29 N5 O2 S2 c1cc(cc(c1....
181 5ADI Ki = 0.507 uM TUE C17 H16 N4 O C=NCc1cc(c....
182 4KCN Ki = 0.011 uM 5H3 C20 H20 F N3 S [H]/N=C(c1....
183 1LZX - H4B C9 H15 N5 O3 C[C@@H]([C....
184 1MMW - H4B C9 H15 N5 O3 C[C@@H]([C....
185 5VUY Ki = 0.274 uM P64 C20 H24 N4 CN(C)c1ccc....
186 4UH4 Ki = 24 nM Q1T C19 H25 N5 Cc1cc(nc(c....
187 4CX4 - HW9 C22 H32 N4 O Cc1ccnc(c1....
188 3JT6 Ki = 32 uM JM6 C10 H21 N3 O2 S [H]/N=C(/C....
189 5UNY Ki = 0.05 uM M4R C22 H24 N4 O Cc1cc(nc2c....
190 3JX1 Ki = 290 nM JI5 C21 H30 F N5 Cc1cc(nc(c....
191 3NLM Ki = 7.2 nM JRR C21 H29 F N4 O Cc1cc(nc(c....
192 4CAM Ki = 0.075 uM M87 C18 H18 F N3 c1cc(cc(c1....
193 1OM5 - H4B C9 H15 N5 O3 C[C@@H]([C....
194 4D31 Ki = 0.183 uM OLW C17 H16 N6 c1cc(cc(c1....
195 5AD8 Ki = 0.16 uM 9M9 C17 H17 N3 O c1cc(cc(c1....
196 5UNU Ki = 0.033 uM 8EY C20 H20 N4 O Cc1cc(nc2c....
197 3UFT Ki = 0.117 uM HW7 C21 H27 Cl F N3 O2 Cc1cc(nc(c....
198 3N63 - XFN C22 H27 N5 Cc1cc(nc(c....
199 3TYL Ki = 0.41 uM AXW C20 H27 F N4 O Cc1cc(nc(c....
200 4EUX Ki = 0.038 uM HW1 C22 H33 N5 O Cc1cc(nc(c....
201 1QWC - H4B C9 H15 N5 O3 C[C@@H]([C....
202 4IMT Ki = 0.11 uM 1EW C25 H33 N5 Cc1cc(nc(c....
203 3JTA Ki = 32 uM JM6 C10 H21 N3 O2 S [H]/N=C(/C....
204 3Q99 - H4B C9 H15 N5 O3 C[C@@H]([C....
205 3DQR Ki = 0.388 uM JI2 C12 H21 N5 c1cc(nc(c1....
206 5VV4 Ki = 0.02 uM 9P7 C20 H20 N4 Cc1cc(ccc1....
207 3B3M Ki = 47.94 uM JI1 C13 H22 N4 O c1cc(nc(c1....
208 5G0O Ki = 748 nM W64 C18 H25 N5 Cc1cc(nc(c....
209 4K5F Ki = 232 nM Q14 C18 H27 N5 O2 Cc1cc(nc(c....
210 5FVO - D8H C17 H24 N4 O Cc1cc(nc(c....
211 3JT7 Ki = 59 uM JM5 C10 H21 N3 O2 S [H]/N=C(/C....
212 5AD5 Ki = 0.332 uM M94 C19 H21 N3 O CNCCc1cccc....
213 4K5E Ki = 32 nM 1Q7 C17 H25 N5 O2 Cc1cc(nc(c....
214 4JSF Ki = 86 nM QJ4 C19 H28 N4 Cc1cc(nc(c....
215 1M00 - BHH C5 H13 N3 O CCCCNC(=N)....
216 3JWU Ki = 171 nM J11 C21 H30 F N5 Cc1cc(nc(c....
217 5FVQ Ki = 43 nM W64 C18 H25 N5 Cc1cc(nc(c....
218 3UFU Ki = 0.074 uM HW8 C21 H30 N4 O Cc1cc(nc(c....
219 5VV1 Ki = 0.073 uM 9OS C19 H22 N4 O COc1ccncc1....
220 1ZVI - H4B C9 H15 N5 O3 C[C@@H]([C....
221 5VUV Ki = 0.768 uM M62 C16 H14 F N3 c1cc(cc(c1....
222 3NLN - H4B C9 H15 N5 O3 C[C@@H]([C....
223 1OM4 - H4B C9 H15 N5 O3 C[C@@H]([C....
224 3B3P Ki = 0.25 uM JI7 C20 H28 Cl N5 Cc1cc(nc(c....
225 3N5V - H4B C9 H15 N5 O3 C[C@@H]([C....
226 4CTW Ki = 24 nM S71 C22 H28 N6 Cc1cc(nc(c....
227 4CTP Ki = 144 nM 2IK C22 H27 N5 Cc1cc(nc(c....
228 4CTT Ki = 903 nM S7K C22 H26 N4 Cc1ccnc(c1....
229 4FVW - H4B C9 H15 N5 O3 C[C@@H]([C....
230 3HSO - H4B C9 H15 N5 O3 C[C@@H]([C....
231 5ADB Kd = 0.058 uM XEB C18 H18 Cl N3 O CNCc1cc(cc....
232 4CTR Ki = 70 nM S20 C22 H26 N4 O Cc1cc(nc(c....
233 1LZZ - H4B C9 H15 N5 O3 C[C@@H]([C....
234 3TYN Ki = 0.39 uM CXW C20 H28 N4 O2 Cc1cc(nc(c....
235 4KCM Ki = 0.049 uM 1QF C27 H29 N5 S2 [H]/N=C(c1....
236 3UFR Ki = 0.637 uM H5W C21 H26 F N3 O Cc1cc(nc(c....
237 4K5D Ki = 382 nM 1Q6 C17 H25 N5 O2 Cc1cc(nc(c....
238 3B3N Ki = 388 nM JI2 C12 H21 N5 c1cc(nc(c1....
239 5AGN Ki = 1.5 uM 4JK C7 H15 N3 O3 [H]/N=C(CO....
240 4UH6 Ki = 55 nM Q1T C19 H25 N5 Cc1cc(nc(c....
241 5UNX Ki = 0.042 uM 8F1 C21 H22 N4 O Cc1cc(nc2c....
242 3JWT Ki = 5.3 nM JI5 C21 H30 F N5 Cc1cc(nc(c....
243 3JX5 - H4B C9 H15 N5 O3 C[C@@H]([C....
244 3NNY Ki = 50 nM 59R C20 H27 F N4 O c1cc(cc(c1....
245 4CTV Ki = 123 nM 7S7 C22 H28 N6 Cc1cc(nc(c....
246 2G6K - H4B C9 H15 N5 O3 C[C@@H]([C....
247 1VAG - H4B C9 H15 N5 O3 C[C@@H]([C....
248 4UCH Ki = 0.138 uM OLW C17 H16 N6 c1cc(cc(c1....
249 3N5X Ki = 103 nM XFK C21 H25 N5 Cc1cc(nc(c....
250 5VV3 Ki = 0.032 uM P94 C19 H18 N4 c1cc(ccc1C....
251 5VUM Ki = 0.038 uM XH8 C18 H20 N4 c1cc(cnc1)....
252 3NLK Ki = 116 nM JSS C21 H29 F N4 O Cc1cc(nc(c....
253 3N61 - H4B C9 H15 N5 O3 C[C@@H]([C....
254 5UO6 Ki = 0.065 uM M4R C22 H24 N4 O Cc1cc(nc2c....
255 4FVX Ki = 26 uM 2KJ C8 H18 N4 O3 [H]/N=C(NC....
256 1P6J Ki = 0.1 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
257 4JSG Ki = 60 nM Q10 C16 H21 N3 O2 Cc1cc(nc(c....
258 4GQE Ki = 7.4 mM 6KJ C10 H20 N4 O3 [H]/N=C(NO....
259 4IMU Ki = 0.053 uM 1ET C23 H29 N5 Cc1cc(nc(c....
260 5VUI Ki = 0.575 uM M62 C16 H14 F N3 c1cc(cc(c1....
261 3N65 - H4B C9 H15 N5 O3 C[C@@H]([C....
262 2G6H - H4B C9 H15 N5 O3 C[C@@H]([C....
263 4D1N - H4B C9 H15 N5 O3 C[C@@H]([C....
264 2G6L - HBI C9 H13 N5 O3 C[C@@H]([C....
265 3HSN - H4B C9 H15 N5 O3 C[C@@H]([C....
266 3NLR - H4B C9 H15 N5 O3 C[C@@H]([C....
267 3NLZ Ki = 0.085 uM 3XD C21 H28 F2 N4 O Cc1cc(nc(c....
268 5UO4 Ki = 0.061 uM 8F1 C21 H22 N4 O Cc1cc(nc2c....
269 5VUU Ki = 0.025 uM 9OJ C21 H22 N4 Cc1cc(ccc1....
270 3N62 - H4B C9 H15 N5 O3 C[C@@H]([C....
271 5ADC Ki = 0.043 uM TUE C17 H16 N4 O C=NCc1cc(c....
272 5VUZ Ki = 0.108 uM XH8 C18 H20 N4 c1cc(cnc1)....
273 4V3U Ki = 0.125 uM EG8 C17 H20 N6 c1cc(cnc1)....
274 4D32 Ki = 0.06 uM 7F5 C19 H22 F N5 Cc1cncn1c2....
275 5VUO Ki = 0.05 uM 9OS C19 H22 N4 O COc1ccncc1....
276 4KCO Ki = 0.073 uM 5H4 C22 H24 F N3 S [H]/N=C(c1....
277 4FVY - 3KJ C7 H16 N4 O3 [H]/N=C(/N....
278 5AD7 Ki = 0.569 uM M85 C18 H19 N3 O CNCc1cccc(....
279 5AGK Ki = 53 uM RGE C8 H17 N3 O3 S [H]/N=C(CS....
280 4KCK Ki = 0.005 uM H45 C25 H25 N5 S2 [H]/N=C(c1....
281 5UO5 Ki = 0.074 uM M4R C22 H24 N4 O Cc1cc(nc2c....
282 3UFS Ki = 0.23 uM HW6 C22 H29 Cl F N3 O Cc1cc(nc(c....
283 5VUX Ki = 0.764 uM 9P1 C19 H22 N4 CN(C)c1ccc....
284 3JX6 Ki = 2180 nM JI5 C21 H30 F N5 Cc1cc(nc(c....
285 4D2Y Ki = 0.018 uM L5Z C19 H20 F N5 c1cc(cc(c1....
286 1K2U - H4B C9 H15 N5 O3 C[C@@H]([C....
287 1ZZU Ki = 63.3 uM DP1 C10 H22 N8 O4 C(C[C@@H](....
288 4JSH Ki = 117 nM Q15 C19 H25 N3 O2 Cc1cc(nc(c....
289 4IMW Ki = 0.056 uM 1EV C23 H25 N5 Cc1cc(nc(c....
290 3UFP Ki = 0.922 uM H4W C22 H30 F N3 O Cc1cc(nc(c....
291 5G0N Ki = 139.4 nM EXI C17 H25 N5 Cc1cc(nc(c....
292 2G6I - HBI C9 H13 N5 O3 C[C@@H]([C....
293 3N60 Ki = 85 nM XFN C22 H27 N5 Cc1cc(nc(c....
294 5VV5 Ki = 0.03 uM 9OJ C21 H22 N4 Cc1cc(ccc1....
295 5VUK Ki = 0.522 uM 9P1 C19 H22 N4 CN(C)c1ccc....
296 5AD4 Ki = 0.468 uM 6M8 C20 H23 N3 O CN(C)CCc1c....
297 3PNF Ki = 0.17 uM 8BX C21 H27 Cl F2 N4 O Cc1cc(nc(c....
298 3SVP Ki = 0.077 uM JK5 C21 H26 Cl F3 N4 O Cc1cc(nc(c....
299 5UO3 - 8EY C20 H20 N4 O Cc1cc(nc2c....
300 4CX3 - HW8 C21 H30 N4 O Cc1cc(nc(c....
301 5AGP Ki = 0.42 uM VUR C7 H15 N3 O2 S [H]/N=C(CS....
302 4JSI Ki = 40 nM Q05 C22 H24 F N3 O Cc1cc(nc(c....
303 5VUW Ki = 1.02 uM JHT C19 H22 N4 CN(C)c1ccc....
304 4FVZ Ki = 28 uM 4KJ C8 H16 N4 O3 [H]/N=C(/N....
305 3JWV Ki = 18.9 nM J14 C21 H30 F N5 Cc1cc(nc(c....
306 2HX4 Ki = 0.31 uM 4HX C11 H22 N8 O5 [H]/N=C(/N....
307 5ADF Ki = 0.657 uM 2SN C19 H22 N4 CN(C)Cc1cc....
308 5VV0 Ki = 0.13 uM 9OM C19 H22 N4 Cc1ccncc1C....
309 4D3B Ki = 0.368 uM 6J0 C17 H19 F N6 c1cc(cc(c1....
310 3HSP - H4B C9 H15 N5 O3 C[C@@H]([C....
311 5FVT Ki = 25 nM W67 C18 H26 N4 Cc1cc(nc(c....
312 4V3X Ki = 0.138 uM 4E8 C18 H20 F N5 c1cc(cc(c1....
313 5AGL Ki = 58.3 uM CCW C8 H17 N3 O4 S CS(=O)(=O)....
314 4D30 Ki = 0.054 uM EG8 C17 H20 N6 c1cc(cnc1)....
315 4CTU Ki = 53 nM S42 C23 H29 N5 Cc1cc(nc(c....
316 5UO0 Ki = 0.05 uM 8FD C22 H24 N4 O Cc1cc(nc2c....
317 3N2R Ki = 3 uM XJH C22 H23 N3 O2 c1ccc(cc1)....
318 3NLX Ki = 0.036 uM 3XB C21 H27 F3 N4 O Cc1cc(nc(c....
319 4CAP Ki = 0.06 uM ML6 C19 H20 F N3 c1cc(cc(c1....
320 5FVU Ki = 84 nM W64 C18 H25 N5 Cc1cc(nc(c....
321 3NLJ - H4B C9 H15 N5 O3 C[C@@H]([C....
322 5AGM Ki = 22.9 uM WT2 C7 H13 N3 O3 C(C[C@@H](....
323 4KCJ Ki = 0.13 uM H36 C24 H22 N4 O2 S2 [H]/N=C(Nc....
324 5FVX Ki = 37 nM W67 C18 H26 N4 Cc1cc(nc(c....
325 4UPO Ki = 0.0281 uM 6E5 C29 H31 N5 O2 S2 [H]/N=C(/c....
326 1K2T - H4B C9 H15 N5 O3 C[C@@H]([C....
327 5VUN Ki = 0.09 uM 9OM C19 H22 N4 Cc1ccncc1C....
328 3JT4 Ki = 33 uM JM8 C10 H21 N3 O2 S [H]/N=C(CC....
329 5ADD - M85 C18 H19 N3 O CNCc1cccc(....
330 4V3W Ki = 0.183 uM E2Z C17 H18 F N5 c1cc(cc(c1....
331 3NLQ - H4B C9 H15 N5 O3 C[C@@H]([C....
332 5VUS Ki = 0.031 uM 9PM C19 H17 Cl N4 c1cc(cc2c1....
333 4UH5 Ki = 59 nM EXI C17 H25 N5 Cc1cc(nc(c....
334 3JWS Ki = 52.2 nM JI4 C21 H30 F N5 Cc1cc(nc(c....
335 3UFV Ki = 0.031 uM HW9 C22 H32 N4 O Cc1ccnc(c1....
336 5UNV Ki = 0.033 uM 8J7 C20 H23 N3 Cc1cc(nc2c....
337 3NNZ Ki = 220 nM 59W C20 H27 F N4 O c1cc(cc(c1....
338 3JX4 - H4B C9 H15 N5 O3 C[C@@H]([C....
339 3N64 - XFN C22 H27 N5 Cc1cc(nc(c....
340 5VUJ Ki = 0.421 uM JHT C19 H22 N4 CN(C)c1ccc....
341 3JT3 Ki = 0.9 uM JM2 C8 H17 N3 O2 S [H]/N=C(CS....
342 5ADE - XEB C18 H18 Cl N3 O CNCc1cc(cc....
343 2G6J - 7AP C9 H12 N6 O2 C[C@@H]([C....
344 3UFQ Ki = 15.402 uM HW5 C22 H28 F N3 O Cc1cc(nc(c....
345 3TYM Ki = 0.82 uM 08R C21 H30 N4 O2 Cc1cc(nc(c....
346 4JSJ Ki = 140 nM QJ7 C21 H23 F N4 O Cc1cc(nc(c....
347 4UH1 Ki = 17 nM EXI C17 H25 N5 Cc1cc(nc(c....
348 5AD9 Ki = 0.283 uM 8VJ C19 H21 N3 O CN(C)Cc1cc....
349 3SVQ Ki = 0.18 uM JK4 C21 H26 F4 N4 O Cc1cc(nc(c....
350 1P6I Ki = 0.15 uM DP3 C8 H21 N7 O2 C(C[C@@H](....
351 3Q9A - H4B C9 H15 N5 O3 C[C@@H]([C....
352 4CAO Ki = 0.164 uM M46 C20 H22 F N3 c1cc(cc(c1....
353 4V3Y Ki = 0.032 uM HLW C18 H20 Cl N5 c1cc(cc(c1....
354 5VUR Ki = 0.021 uM 9P7 C20 H20 N4 Cc1cc(ccc1....
355 5G0P Ki = 108 nM W67 C18 H26 N4 Cc1cc(nc(c....
356 5UO2 Ki = 0.125 uM 8J4 C20 H23 N3 O CCc1cc(cc(....
357 2G6N - HBI C9 H13 N5 O3 C[C@@H]([C....
358 5ADG Ki = 0.295 uM XEB C18 H18 Cl N3 O CNCc1cc(cc....
359 4UPP Ki = 0.0282 uM PQW C27 H27 N5 O2 S2 [H]/N=C(/c....
360 4LUX Kd = 0.1 uM QJ8 C19 H27 N5 O2 Cc1cc(nc(c....
361 4CX5 - HW8 C21 H30 N4 O Cc1cc(nc(c....
362 4V3V Ki = 0.138 uM S8F C17 H18 F N5 c1cc(cc(c1....
363 4K5G Ki = 37 nM Q13 C18 H27 N5 O2 Cc1cc(nc(c....
364 3NLY Ki = 0.16 uM 3XC C21 H27 F3 N4 O Cc1cc(nc(c....
365 5FVP Ki = 547 nM WOS C17 H22 N4 O Cc1cc(nc(c....
366 3JT5 Ki = 8.6 uM JM7 C9 H19 N3 O2 S [H]/N=C(CS....
367 5AGO Ki = 0.42 uM VUR C7 H15 N3 O2 S [H]/N=C(CS....
368 5VUP Ki = 0.216 uM 9P4 C18 H19 F N4 c1cc(cc2c1....
369 5FW0 Ki = 1768 nM W30 C17 H24 N4 O Cc1cc(nc(c....
370 4KCI Ki = 0.739 uM 1QE C24 H22 N4 S2 [H]/N=C(Nc....
371 4UPM Ki = 0.059 uM I5U C27 H29 N5 O2 S2 [H]/N=C(c1....
372 3PNE Ki = 0.086 uM 8AX C21 H27 Cl F2 N4 O Cc1cc(nc(c....
373 5UNW Ki = 0.036 uM 8F7 C21 H22 N4 Cc1cc(nc2c....
374 4V3Z Ki = 0.056 uM 9HL C19 H20 F N5 c1cc(cc(c1....
375 5FVR Ki = 72 nM H65 C19 H26 N4 Cc1cc(nc(c....
376 4CDT Ki = 0.049 uM M48 C19 H20 F N3 c1cc(cc(c1....
377 4FW0 Ki > 10 mM 5KJ C7 H16 N4 O3 [H]/N=C(NO....
378 4UH2 Ki = 67 nM S84 C19 H25 F3 N4 Cc1cc(nc(c....
379 5UO7 Ki = 0.046 uM 8FD C22 H24 N4 O Cc1cc(nc2c....
380 3JT8 - H4B C9 H15 N5 O3 C[C@@H]([C....
381 1ZVL - H4B C9 H15 N5 O3 C[C@@H]([C....
382 4CTQ Ki = 122 nM S5D C22 H27 N5 Cc1cc(nc(c....
383 4IMS Ki = 0.54 uM 12S C25 H33 N5 Cc1cc(nc(c....
384 3TYO Ki = 0.4 uM DXW C18 H26 N4 O2 Cc1cc(nc(c....
385 1RS7 - D7P C15 H25 N7 O4 c1ccc(cc1)....
386 4KCL Ki = 0.005 uM H44 C25 H25 N5 S2 [H]/N=C(/c....
387 3NLO - H4B C9 H15 N5 O3 C[C@@H]([C....
388 4UH0 Ki = 35 nM SKO C17 H25 N5 Cc1cc(nc(c....
389 3UFO Ki = 9.057 uM HW4 C22 H30 F N3 O Cc1cc(nc(c....
390 4D2Z Ki = 0.15 uM K9L C19 H20 F N5 c1cc(cc(c1....
391 5UNR Ki = 0.035 uM 8EV C19 H18 N4 O CNCc1cc(cc....
392 5ADA Ki = 0.375 uM 2SN C19 H22 N4 CN(C)Cc1cc....
393 1P6K Ki = 67 uM DP1 C10 H22 N8 O4 C(C[C@@H](....
394 5FVV Ki = 89 nM H65 C19 H26 N4 Cc1cc(nc(c....
395 3JX2 Ki = 1190 nM JI4 C21 H30 F N5 Cc1cc(nc(c....
396 3UFW Ki = 0.03 uM HW0 C21 H31 N5 O Cc1cc(nc(c....
397 5VV2 Ki = 0.164 uM 9P4 C18 H19 F N4 c1cc(cc2c1....
398 5UO1 Ki = 0.036 uM 8EV C19 H18 N4 O CNCc1cc(cc....
399 3N5W Ki = 25 nM XFJ C21 H25 N5 Cc1cc(nc(c....
400 3PNG Ki = 0.026 uM 8CX C21 H28 F2 N4 O Cc1cc(nc(c....
401 3B3O Ki = 0.085 uM JI3 C20 H28 Cl N5 Cc1cc(nc(c....
402 4C39 Ki = 9.7 nM Q16 C19 H27 N5 O2 Cc1cc(nc(c....
403 5VUL Ki = 0.036 uM P64 C20 H24 N4 CN(C)c1ccc....
404 1K2R - H4B C9 H15 N5 O3 C[C@@H]([C....
405 1QW6 - H4B C9 H15 N5 O3 C[C@@H]([C....
406 3JT9 Ki = 8.6 uM JM7 C9 H19 N3 O2 S [H]/N=C(CS....
407 3JX0 Ki = 1190 nM JI4 C21 H30 F N5 Cc1cc(nc(c....
408 5AD6 Ki = 0.179 uM 7M3 C19 H21 N3 O CN(C)Cc1cc....
409 1MMV - H4B C9 H15 N5 O3 C[C@@H]([C....
410 4UH3 Ki = 34 nM S85 C18 H25 F N4 Cc1cc(nc(c....
411 1ZZQ Ki = 20 uM DP9 C11 H22 N8 O4 C1[C@H](CN....
412 1P6H Ki = 0.3 uM DP1 C10 H22 N8 O4 C(C[C@@H](....
413 5FVS Ki = 16 nM W66 C17 H24 N4 Cc1cc(nc(c....
414 3NM0 Ki = 0.17 uM 3XE C21 H32 F2 N4 O C[C@H]1C[C....
415 3N66 - XFN C22 H27 N5 Cc1cc(nc(c....
416 5VUQ Ki = 0.037 uM P94 C19 H18 N4 c1cc(ccc1C....
417 2G6M - H4B C9 H15 N5 O3 C[C@@H]([C....
418 3NLV Ki = 0.39 uM 3XA C21 H27 F3 N4 O Cc1cc(nc(c....
419 3N5Z Ki = 195 nM XFM C21 H25 N5 Cc1cc(nc(c....
420 1RS6 - DP2 C12 H28 N8 O4 C(CCN)C[C@....
421 4CAN Ki = 0.254 uM M7K C18 H18 F N3 c1cc(cc(c1....
422 4CX6 - Q16 C19 H27 N5 O2 Cc1cc(nc(c....
423 4KCH Ki = 0.787 uM H38 C22 H18 N4 S2 [H]/N=C(Nc....
424 5UNT Ki = 0.039 uM 8J1 C19 H21 N3 O Cc1cc(nc2c....
425 5G6E - H4B C9 H15 N5 O3 C[C@@H]([C....
426 4UG9 - 1EW C25 H33 N5 Cc1cc(nc(c....
427 4UGH - H4B C9 H15 N5 O3 C[C@@H]([C....
428 2FBZ - HAR C6 H14 N4 O3 C(C[C@@H](....
429 5G6B - M48 C19 H20 F N3 c1cc(cc(c1....
430 4D3V - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
431 5G6N - 8VJ C19 H21 N3 O CN(C)Cc1cc....
432 4UG5 - XFK C21 H25 N5 Cc1cc(nc(c....
433 4UGR - 6E5 C29 H31 N5 O2 S2 [H]/N=C(/c....
434 5G6K - M94 C19 H21 N3 O CNCCc1cccc....
435 4UG8 - HW1 C22 H33 N5 O Cc1cc(nc(c....
436 4UGG - S5D C22 H27 N5 Cc1cc(nc(c....
437 4D7I - 0GD C21 H22 F N3 Cc1cc(nc(c....
438 5G6O - 8VJ C19 H21 N3 O CN(C)Cc1cc....
439 4UGQ - 7LN C27 H29 N5 O2 S2 c1cc(cc(c1....
440 4UGW - HW1 C22 H33 N5 O Cc1cc(nc(c....
441 5G6F - 2SN C19 H22 N4 CN(C)Cc1cc....
442 5G6L - XEB C18 H18 Cl N3 O CNCc1cc(cc....
443 5G69 - H4B C9 H15 N5 O3 C[C@@H]([C....
444 4UGS - H36 C24 H22 N4 O2 S2 [H]/N=C(Nc....
445 5G6C - H4B C9 H15 N5 O3 C[C@@H]([C....
446 4UGC - 1Q6 C17 H25 N5 O2 Cc1cc(nc(c....
447 4UGE - H4B C9 H15 N5 O3 C[C@@H]([C....
448 4D3K - 12S C25 H33 N5 Cc1cc(nc(c....
449 4UG7 - 1EV C23 H25 N5 Cc1cc(nc(c....
450 4UGT - UGT C16 H19 N3 O S c1cc(cc(c1....
451 4UGF - Q16 C19 H27 N5 O2 Cc1cc(nc(c....
452 4LWB Kd = 4.4 uM QJ8 C19 H27 N5 O2 Cc1cc(nc(c....
453 4UG6 - H4B C9 H15 N5 O3 C[C@@H]([C....
454 5G6D - JHT C19 H22 N4 CN(C)c1ccc....
455 4D7J - 0GD C21 H22 F N3 Cc1cc(nc(c....
456 4UGY - H4B C9 H15 N5 O3 C[C@@H]([C....
457 5G6A - H4B C9 H15 N5 O3 C[C@@H]([C....
458 1M7V - THG C19 H23 N7 O6 c1cc(ccc1C....
459 2FC2 - HBI C9 H13 N5 O3 C[C@@H]([C....
460 4D3J - XFN C22 H27 N5 Cc1cc(nc(c....
461 5G6M - 9M9 C17 H17 N3 O c1cc(cc(c1....
462 4UQR - H4B C9 H15 N5 O3 C[C@@H]([C....
463 4UGL - S90 C20 H27 F N4 Cc1cc(nc(c....
464 4UGM - H4B C9 H15 N5 O3 C[C@@H]([C....
465 4D3O - S97 C24 H27 N5 Cc1cc(nc(c....
466 4UGA - Q05 C22 H24 F N3 O Cc1cc(nc(c....
467 5G6J - M94 C19 H21 N3 O CNCCc1cccc....
468 4UGP - H4B C9 H15 N5 O3 C[C@@H]([C....
469 4UGV - H4B C9 H15 N5 O3 C[C@@H]([C....
470 5G66 - M5K C10 H10 N2 Cc1cc(nc2c....
471 4D3I - 1ET C23 H29 N5 Cc1cc(nc(c....
472 4UGK - 7S9 C17 H24 N4 Cc1cc(nc(c....
473 4D3N - SK6 C22 H23 N5 Cc1cc(nc(c....
474 4D3U - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
475 4UGN - H49 C17 H22 N4 S c1cc(cc(c1....
476 5G67 - M87 C18 H18 F N3 c1cc(cc(c1....
477 5G6Q - TUE C17 H16 N4 O C=NCc1cc(c....
478 4UGX - 5H4 C22 H24 F N3 S [H]/N=C(c1....
479 4D3M - IVU C24 H27 N5 Cc1cc(nc(c....
480 4UGJ - H4B C9 H15 N5 O3 C[C@@H]([C....
481 2FC1 - HBI C9 H13 N5 O3 C[C@@H]([C....
482 5G6P - 8VJ C19 H21 N3 O CN(C)Cc1cc....
483 4UGO - 1QF C27 H29 N5 S2 [H]/N=C(c1....
484 5G6G - M85 C18 H19 N3 O CNCc1cccc(....
485 4D7H - M46 C20 H22 F N3 c1cc(cc(c1....
486 4UQS - INE C7 H4 Br N3 O2 c1cc2c(c(c....
487 5G68 - ML6 C19 H20 F N3 c1cc(cc(c1....
488 1M7Z - THG C19 H23 N7 O6 c1cc(ccc1C....
489 4UGB - QJ7 C21 H23 F N4 O Cc1cc(nc(c....
490 4UGD - Q14 C18 H27 N5 O2 Cc1cc(nc(c....
491 5G6I - H4B C9 H15 N5 O3 C[C@@H]([C....
492 4D3T - RFQ C24 H21 N4 O2 S2 [H]/N=C(/c....
493 5G65 - 2AQ C9 H8 N2 c1ccc2c(c1....
494 5G6H - H4B C9 H15 N5 O3 C[C@@H]([C....
495 4UGI - SKO C17 H25 N5 Cc1cc(nc(c....
496 4LWA Kd = 1.1 uM Q13 C18 H27 N5 O2 Cc1cc(nc(c....
497 4UGU - PQW C27 H27 N5 O2 S2 [H]/N=C(/c....
498 4NOS Ki = 19 nM ITU C3 H8 N2 S CCSC(=N)N
499 3E7G ic50 = 0.35 uM AT2 C14 H21 N3 O2 CCOC(=O)N1....
500 1MJT - ITU C3 H8 N2 S CCSC(=N)N
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: HAR; Similar ligands found: 34
No: Ligand ECFP6 Tc MDL keys Tc
1 HAR 1 1
2 NRG 0.666667 0.722222
3 NNH 0.65 0.928571
4 1KJ 0.644444 0.906977
5 RPI 0.630435 0.711538
6 ILO 0.619048 0.659091
7 CIR 0.6 0.681818
8 AS1 0.591837 0.717391
9 2KJ 0.591837 0.886364
10 D20 0.591837 0.673469
11 VUR 0.590909 0.681818
12 4JK 0.590909 0.704545
13 DAR 0.585366 0.780488
14 ARG 0.585366 0.780488
15 WT2 0.577778 0.714286
16 DA2 0.565217 0.64
17 3KJ 0.553191 0.829787
18 ONH 0.55 0.804878
19 JM2 0.541667 0.625
20 LN6 0.52 0.617021
21 HRG 0.511111 0.780488
22 JM7 0.509804 0.625
23 JM4 0.509434 0.6
24 3AR 0.5 0.711111
25 VIO 0.489796 0.617021
26 JM6 0.481481 0.6
27 JM8 0.481481 0.612245
28 JM5 0.472727 0.612245
29 AHL 0.468085 0.787234
30 5KJ 0.431373 0.78
31 BHH 0.428571 0.772727
32 ORN 0.414634 0.625
33 6HN 0.413043 0.607843
34 AAR 0.4 0.622222
Ligand no: 2; Ligand: HBI; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 HBI 1 1
2 44W 0.519231 0.816667
3 PH2 0.464286 0.852459
4 ZSP 0.45 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4LWA; Ligand: Q13; Similar sites found: 14
This union binding pocket(no: 1) in the query (biounit: 4lwa.bio1) has 58 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4CQK PIO 0.03956 0.41413 None
2 3TII ANP 0.03833 0.40653 1.65289
3 4D3S BOG 0.0457 0.40601 3.07167
4 4YZ5 SLT 0.03509 0.40869 3.30579
5 3VOT ADP 0.02687 0.41466 3.58127
6 1MUU SUC 0.01631 0.42239 4.40771
7 1SQL GUN 0.04592 0.41318 4.79452
8 1CEB AMH 0.01758 0.42363 5.68182
9 2G77 AF3 0.0431 0.41243 6.56566
10 2GOO NDG 0.02877 0.43035 6.86275
11 4BTV RB3 0.04367 0.41391 8.72093
12 4L4J NAG NAG BMA MAN NAG 0.03939 0.40946 12.2172
13 2WUL GSH 0.03496 0.41232 13.5593
14 1ZX5 LFR 0.03591 0.40529 19.3333
Pocket No.: 2; Query (leader) PDB : 4LWA; Ligand: Q13; Similar sites found: 339
This union binding pocket(no: 2) in the query (biounit: 4lwa.bio2) has 58 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2E1A MSE 0.003195 0.44351 None
2 1LNX URI 0.01351 0.42053 None
3 3MD0 GDP 0.01267 0.41726 1.12676
4 3K3G MMU 0.01685 0.41847 1.17647
5 3UDG TMP 0.006484 0.46646 1.3289
6 2Q8H TF4 0.02298 0.43681 1.37741
7 1C1L GAL BGC 0.002769 0.47056 1.45985
8 3WUD GLC GAL 0.02428 0.42918 1.47059
9 4NAO AKG 0.02781 0.42048 1.53374
10 4HZO COA 0.02631 0.40736 1.57233
11 1YHM AHD 0.02436 0.41334 1.65746
12 1RZM E4P 0.002597 0.47195 1.77515
13 1RZM PEP 0.003578 0.44662 1.77515
14 1CKN GTP 0.01206 0.41821 1.81818
15 1CKM GTP 0.01424 0.41504 1.81818
16 1NPL MAN MAN 0.02568 0.42791 1.83486
17 1WTC ACP 0.01511 0.43379 1.85759
18 1F1V DHY 0.008595 0.42467 1.85759
19 2QCX PF1 0.01076 0.42998 1.90114
20 2DVZ GLU 0.00846 0.42052 1.91083
21 1NOW IFG 0.004722 0.44666 1.92837
22 3T1A 5MA 0.002147 0.42395 1.92837
23 3PLN U5P 0.01521 0.41819 1.92837
24 3VCA PRO 0.02414 0.41125 1.92837
25 4IHQ ADP 0.02265 0.40614 1.92837
26 1B74 DGN 0.007054 0.45706 1.9685
27 4IXW IXW 0.02435 0.40475 1.9685
28 3MCT 3MC 0.01759 0.41532 2.0202
29 4NES UDP 0.00379 0.41845 2.13904
30 4JWX 1N4 0.009962 0.42652 2.14286
31 1II5 GLU 0.0194 0.41799 2.14592
32 2JC9 ADN 0.005549 0.43802 2.20386
33 1H0C AOA 0.01289 0.43725 2.20386
34 1GPJ CIT 0.009912 0.43706 2.20386
35 4ME6 ADP 0.01122 0.42913 2.20386
36 2PP3 LGT 0.003351 0.42859 2.20386
37 1PEA ACM 0.02639 0.42729 2.20386
38 1T10 F6P 0.01742 0.42018 2.20386
39 4M51 BEZ 0.0427 0.41633 2.20386
40 4KCT PYR 0.01452 0.41466 2.20386
41 4KCF FMN 0.01541 0.40551 2.20386
42 2Q37 3AL 0.01559 0.42244 2.20994
43 2VAR AMP 0.01184 0.41428 2.23642
44 2VAR KDF 0.01388 0.4074 2.23642
45 4Q0A GLY HIS LYS ILE LEU HIS ARG LEU LEU GLN 0.005289 0.40935 2.31788
46 1M1B SPV 0.002421 0.46017 2.37288
47 1OGZ EQU 0.005425 0.42433 2.4
48 1RYD GLC 0.01249 0.43222 2.47934
49 1FBL HTA 0.01095 0.41573 2.47934
50 1WDA BAG 0.02163 0.40702 2.47934
51 1X8X TYR 0.01848 0.40601 2.48447
52 3VPD CIT 0.005091 0.48074 2.4911
53 3VPD BUA 0.01046 0.46939 2.4911
54 1YOA FMN 0.007726 0.47991 2.51572
55 1ZUW DGL 0.02852 0.40171 2.57353
56 2YCJ C2F 0.01146 0.40706 2.58303
57 3UBW 6SP 0.006741 0.47235 2.68199
58 1P72 THM 0.01792 0.41495 2.69461
59 4BI7 PGA 0.01202 0.41827 2.72374
60 4BT5 23B 0.02623 0.40331 2.72374
61 3F81 STT 0.01814 0.44238 2.73224
62 2Z9V PXM 0.006153 0.43599 2.75482
63 4RJK PYR 0.03354 0.42185 2.75482
64 1C7R PA5 0.009785 0.41782 2.75482
65 2EJU SAH 0.003329 0.41685 2.75482
66 1Q11 TYE 0.01686 0.41616 2.75482
67 1PX8 XYP 0.02885 0.40988 2.75482
68 3UER BTU 0.01926 0.40148 2.75482
69 3UER TUR 0.01926 0.40148 2.75482
70 1W3R PYR 0.02988 0.42447 2.77778
71 1YOE RIB 0.00359 0.44129 2.79503
72 2OFE NAG 0.006707 0.44524 2.8169
73 2OFD NGA 0.01833 0.42415 2.8169
74 1C3V PDC 0.01016 0.43113 2.85714
75 1NF8 BOG 0.02558 0.42231 2.89855
76 1NF8 ISC 0.01629 0.4045 2.89855
77 1NX4 AKG 0.008684 0.43432 2.9304
78 1Z44 NPO 0.01446 0.46392 2.95858
79 1Z42 HBA 0.01685 0.46003 2.95858
80 1Z44 FMN 0.008325 0.41266 2.95858
81 1Z41 FMN 0.01263 0.4018 2.95858
82 2WOR 2AN 0.01705 0.42567 3
83 3ZPG 5GP 0.01842 0.44202 3.0303
84 4O8A 2OP 0.01883 0.44151 3.0303
85 4JRB PGT 0.002768 0.43642 3.0303
86 1KC7 PPR 0.0218 0.42581 3.0303
87 4C2G ALA ALA ALA ALA 0.01009 0.42161 3.0303
88 3WKX FUB 0.0473 0.40406 3.0303
89 3A2Y TS5 0.01008 0.40219 3.04569
90 1CTU ZEB 0.007827 0.4064 3.06122
91 1HQL GLA MBG 0.002811 0.47024 3.11284
92 1FP2 HMO 0.005491 0.41602 3.125
93 1FP2 SAH 0.008971 0.41135 3.125
94 2Y0I AKG 0.03738 0.40456 3.125
95 3P3N AKG 0.03411 0.41102 3.15186
96 4B7E OGA 0.03993 0.4032 3.15186
97 2XUM OGA 0.04962 0.40304 3.15186
98 2WA4 069 0.01986 0.40092 3.15186
99 2QGI UDP 0.002303 0.46118 3.22581
100 1SS4 CIT 0.0002013 0.56204 3.26797
101 1SS4 GSH 0.01247 0.47278 3.26797
102 1NXJ GLV 0.02282 0.40599 3.27869
103 1UF5 CDT 0.001375 0.45409 3.30033
104 2WMO GTP 0.00645 0.41713 3.30579
105 3W2W ATP 0.01726 0.40346 3.30579
106 4IS0 GDS 0.01013 0.40211 3.3195
107 3UST FAD 0.009163 0.40728 3.37079
108 4E28 9MZ 0.01234 0.43246 3.38462
109 4E28 0MZ 0.04011 0.40311 3.38462
110 3LST SAH 0.01217 0.406 3.44828
111 3QDT A2G GAL 0.002713 0.4785 3.4965
112 3QDV A2G 0.004257 0.47628 3.4965
113 3QDY A2G GAL 0.009332 0.45076 3.4965
114 3QDW A2G 0.01459 0.44749 3.4965
115 3QDW NDG 0.02417 0.42355 3.4965
116 3QDV NDG 0.0487 0.40815 3.4965
117 1QO0 BMD 0.0105 0.43584 3.57143
118 2WCV FUC 0.03086 0.40019 3.57143
119 2BO4 FLC 0.005239 0.45677 3.58127
120 1C7S CBS 0.002033 0.44196 3.58127
121 3K5X P8D 0.002736 0.44139 3.58127
122 2F2U M77 0.003871 0.43498 3.58127
123 3TFC PEP 0.0159 0.41731 3.58127
124 2YKX AKG 0.03214 0.41731 3.58127
125 1E2S CSN 0.009348 0.41063 3.58127
126 4JCA CIT 0.003959 0.48686 3.59281
127 1I0Z OXM 0.006334 0.46701 3.6036
128 3NFZ 3NF 0.007956 0.41744 3.66972
129 4USS GSH 0.005401 0.43854 3.69231
130 4W6Z ETF 0.02304 0.43675 3.7464
131 4JP3 CIT 0.008155 0.41699 3.76569
132 3I7S PYR 0.01405 0.44155 3.76712
133 3GM5 CIT 0.04478 0.40523 3.77358
134 3CXQ GLP 0.01261 0.42675 3.80435
135 1RYI GOA 0.001029 0.5277 3.85675
136 2YIV NBN 0.02711 0.42104 3.85675
137 2YIV YIV 0.04021 0.41771 3.85675
138 1KYZ SAH 0.004358 0.41249 3.85675
139 4LHM AZZ 0.02843 0.41018 3.85675
140 2DDH HXD 0.004239 0.40613 3.85675
141 4COQ SAN 0.04303 0.40608 3.85675
142 3MTW M3R 0.01036 0.40518 3.85675
143 2Q09 DI6 0.02742 0.40246 3.85675
144 2R00 OEG 0.02317 0.42448 3.86905
145 5CSM TRP 0.01378 0.42014 3.90625
146 1G8S MET 0.0132 0.43105 3.91304
147 2X2T GAL NGA 0.003531 0.48064 3.92157
148 3PMD 11A 0.01918 0.40532 3.92157
149 1XE7 GUN 0.0253 0.43455 3.94089
150 4F4S EFO 0.004849 0.44066 3.94737
151 3W54 RNB 0.005632 0.41951 3.95137
152 1Y7P RIP 0.01408 0.42969 4.03587
153 3GJB AKG 0.00101 0.46538 4.07523
154 3IHB TRS 0.005537 0.51469 4.13223
155 3E5P PPI 0.03531 0.4477 4.13223
156 3IHB GLU 0.02611 0.42186 4.13223
157 4WBD CIT 0.03919 0.41829 4.13223
158 1VBH PEP 0.04423 0.40109 4.13223
159 4ORR PE3 0.001189 0.412 4.21053
160 4P9Z NMI PTR 02K ASN NH2 0.01218 0.42256 4.2735
161 3RF4 FUN 0.02705 0.40681 4.31034
162 2CW6 3HG 0.001156 0.50666 4.36242
163 1TUV VK3 0.03803 0.42491 4.38596
164 1KYV RBF 0.004411 0.41593 4.40252
165 1FP1 HCC 0.001657 0.42814 4.40771
166 4CIB 7UZ 0.02435 0.41335 4.40771
167 3CL5 SIO 0.04559 0.40961 4.40771
168 1FP1 SAH 0.01019 0.40547 4.40771
169 4NM5 ADP 0.004599 0.40171 4.40771
170 1ZGA HMK 0.01346 0.40795 4.48179
171 3GD8 BOG 0.03239 0.42264 4.4843
172 3PNA CMP 0.02089 0.40769 4.54545
173 2PYU IMP 0.03094 0.40844 4.56621
174 2P69 PLP 0.01633 0.42149 4.57516
175 3LTW HLZ 0.001872 0.47191 4.64286
176 2NCD ADP 0.00371 0.45154 4.6832
177 1H16 DTL 0.01332 0.44962 4.6832
178 3CF6 SP1 0.009441 0.40677 4.79042
179 3UEC ALA ARG TPO LYS 0.02923 0.41939 4.79452
180 1O9U ADZ 0.004434 0.47533 4.85714
181 2W3L DRO 0.01801 0.44255 4.86111
182 1B8U NAD 0.005811 0.40126 4.86322
183 1WRA PC 0.03301 0.41673 4.87013
184 2XI7 XI7 0.0004544 0.55193 4.8913
185 1Y1A GSH 0.001009 0.5409 4.91803
186 1A59 CIT 0.003096 0.46815 4.95868
187 3L6R MLI 0.01605 0.43248 4.95868
188 3R51 MMA 0.005837 0.46891 5
189 1LSS NAD 0.00184 0.41899 5
190 3I6B KDO 0.0298 0.40489 5
191 3KMT SAH 0.002547 0.43339 5.04202
192 1JGS SAL 0.006488 0.48436 5.07246
193 4N7C AEF 0.03076 0.41827 5.11364
194 2OWZ CIT 0.03044 0.41344 5.12048
195 1SOW OXL 0.02155 0.43833 5.18293
196 2YD6 FLC 0.0008611 0.55503 5.18868
197 2Q3M MLA 0.01674 0.44427 5.21472
198 1WHT BZS 0.01112 0.43465 5.22876
199 4B16 NAG 0.006609 0.47439 5.26316
200 3KJQ B94 0.002104 0.44134 5.26316
201 1ZJ6 G3D 0.003777 0.43083 5.34759
202 3SHR CMP 0.01349 0.41186 5.35117
203 1V7R CIT 0.03266 0.4353 5.37634
204 1Y8O ADP 0.02303 0.40191 5.46875
205 3D3H M4O 0.002905 0.42686 5.5
206 2W8Q SIN 0.01456 0.43459 5.50964
207 1YBH P22 0.01196 0.4141 5.50964
208 3WCS MAN NAG GAL 0.006859 0.4244 5.51181
209 3WCS MAN NAG 0.03042 0.40448 5.51181
210 2J0W ASP 0.0399 0.41255 5.56793
211 1QR0 COA 0.0182 0.4063 5.70175
212 3P0F BAU 0.0112 0.40386 5.72391
213 3T2W BTN 0.00422 0.43338 5.7377
214 1H2M OGA 0.03347 0.41143 5.76923
215 2XDQ MGX 0.01934 0.44087 5.78512
216 1GJW GLC 0.02241 0.4252 5.78512
217 1GJW MAL 0.008921 0.41953 5.78512
218 1HFA PIO 0.0002952 0.57045 5.88235
219 1KO0 DLY 0.03273 0.41691 5.88235
220 4K7O EKZ 0.004159 0.46177 5.95238
221 1PTR PRB 0.03562 0.41505 6
222 3CEV ARG 0.0198 0.40872 6.02007
223 2PR5 FMN 0.003246 0.41726 6.06061
224 1B5E DCM 0.01309 0.41664 6.09756
225 1OGD RIP 0.01833 0.41451 6.10687
226 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.004602 0.46665 6.12245
227 1S8F GDP 0.01344 0.40426 6.21469
228 1SJW NGV 0.01045 0.40503 6.25
229 2YLD CMO 0.03118 0.41293 6.29921
230 1OIK AKG 0.02682 0.41612 6.31229
231 2ZJF BSU 0.0197 0.40482 6.35359
232 2EB5 OXL 0.006049 0.4474 6.36704
233 2ZSC BTN 0.01396 0.40359 6.38298
234 4ASJ N6A 0.001594 0.41428 6.48464
235 1BTN I3P 0.002847 0.51355 6.60377
236 2ZJ5 ADP 0.003953 0.45026 6.61157
237 3QV9 QV7 0.006531 0.44009 6.61157
238 2BZ1 TAU 0.001032 0.53111 6.63265
239 3EW2 BTN 0.01076 0.42039 6.66667
240 1GU3 BGC BGC BGC BGC BGC 0.005327 0.43882 6.71141
241 2CJE DUN 0.002593 0.41721 6.71642
242 1Y9Q MED 0.03066 0.41329 6.77083
243 1Y75 NAG 0.008097 0.42581 6.77966
244 3U1T MLI 0.03594 0.41486 6.79612
245 2DWU DGL 0.01007 0.42165 6.88406
246 1Z45 UPG 0.004604 0.4116 6.88705
247 1Z45 GAL 0.02929 0.40523 6.88705
248 1FW1 GSH 0.00691 0.41593 6.94444
249 2BOI MFU 0.01998 0.41281 7.07965
250 2PFC PLM 0.004944 0.42599 7.10383
251 2NZU BG6 0.01848 0.41435 7.14286
252 1MQ0 BRD 0.0162 0.40097 7.14286
253 4G10 GSH 0.005562 0.4158 7.16981
254 2P41 G1G 0.00177 0.45474 7.21311
255 2P41 SAH 0.007727 0.40321 7.21311
256 1H2K OGA 0.02675 0.41618 7.31707
257 2E2R 2OH 0.0003777 0.40341 7.37705
258 4JLV ADP 0.02402 0.44675 7.43494
259 1L1Q 9DA 0.00139 0.42706 7.52688
260 3R6K FUC GAL GLA 0.001532 0.48336 7.54098
261 3RGG AIR 0.01753 0.407 7.54717
262 2JBH 5GP 0.01953 0.40898 7.55556
263 1U3I GSH 0.008981 0.43364 7.58294
264 2ALG DAO 0.02142 0.41597 7.6087
265 1MOQ GLP 0.001456 0.43022 7.7135
266 2VQ5 HBA 0.02017 0.4275 7.7135
267 4AMV F6R 0.002834 0.42729 7.7135
268 3AYS CT3 0.02321 0.40176 7.7135
269 4F2Q QUS 0.01512 0.40219 7.75194
270 2VKL MLT 0.03346 0.4347 7.77778
271 1R5A GTS 0.006168 0.43099 7.79817
272 1EJE FMN 0.007589 0.4035 7.8125
273 3SBZ MLI 0.03131 0.42951 7.93651
274 1T3D CYS 0.01034 0.44204 7.98898
275 3TKA CTN 0.01909 0.43824 8.06916
276 4K30 NLG 0.0336 0.4025 8.125
277 2BKA NDP 0.0009187 0.40638 8.26446
278 4F8L GAL 0.007971 0.47912 8.27586
279 1YFZ IMP 0.01768 0.41988 8.29268
280 4B9E FAH 0.01871 0.42914 8.30565
281 9LDB OXM 0.02902 0.43822 8.43373
282 9LDT OXM 0.03934 0.4307 8.43373
283 3RK0 AMP 0.01224 0.40967 8.43882
284 1BCJ NGA 0.03694 0.43591 8.44156
285 3SQG COM 0.02438 0.4425 8.53994
286 1B55 4IP 0.006976 0.41576 8.87574
287 2V5E SCR 0.00576 0.47774 8.91089
288 2G36 TRP 0.023 0.41452 9.11765
289 3RKR NAP 0.02464 0.40065 9.16031
290 1H2B OCA 0.03651 0.40504 9.1922
291 2JGS BTN 0.01773 0.41745 9.23077
292 2ZWS PLM 0.0001035 0.5895 9.36639
293 3CBG FER 0.02839 0.43183 9.48276
294 3BLI PYR 0.0043