Receptor
PDB id Resolution Class Description Source Keywords
4HZX 2.2 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF INFLUENZA A NEURAMINIDASE N3 COMPLEXED OSELTAMIVIR INFLUENZA A VIRUS NEURAMINIDASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: FUNCTIONAL AND STRUCTURAL ANALYSIS OF INFLUENZA VIR NEURAMINIDASE N3 OFFERS FURTHER INSIGHT INTO THE ME OF OSELTAMIVIR RESISTANCE. J.VIROL. V. 87 10016 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:507;
A:506;
Invalid;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
NAG FUC A:504;
Invalid;
none;
submit data
367.351 n/a O=C(N...
G39 A:508;
Valid;
none;
ic50 = 0.5 nM
284.351 C14 H24 N2 O4 CCC(C...
NAG NAG FUC A:501;
Invalid;
none;
submit data n/a n/a n/a n/a
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4HZX 2.2 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF INFLUENZA A NEURAMINIDASE N3 COMPLEXED OSELTAMIVIR INFLUENZA A VIRUS NEURAMINIDASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: FUNCTIONAL AND STRUCTURAL ANALYSIS OF INFLUENZA VIR NEURAMINIDASE N3 OFFERS FURTHER INSIGHT INTO THE ME OF OSELTAMIVIR RESISTANCE. J.VIROL. V. 87 10016 2013
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 4HZZ ic50 = 8.31 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
2 4I00 - ZMR C12 H20 N4 O7 CC(=O)N[C@....
3 4HZW ic50 = 1.31 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
4 4HZX ic50 = 0.5 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 217 families.
1 4HZZ ic50 = 8.31 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
2 4I00 - ZMR C12 H20 N4 O7 CC(=O)N[C@....
3 4HZW ic50 = 1.31 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
4 4HZX ic50 = 0.5 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
50% Homology Family (103)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 14 families.
1 2HTQ - ZMR C12 H20 N4 O7 CC(=O)N[C@....
2 2HT5 - NDG C8 H15 N O6 CC(=O)N[C@....
3 3O9J - RP6 C14 H21 N O8 CC(=O)N[C@....
4 2HTU - BCZ C15 H28 N4 O4 CCC(CC)[C@....
5 4D8S ic50 = 0.32 uM 0HX C13 H21 N O6 CCC(CC)O[C....
6 2HTR - DAN C11 H17 N O8 CC(=O)N[C@....
7 3O9K - ETT C21 H27 N O8 Cc1ccc(cc1....
8 4M3M - 22N C14 H24 N2 O4 CCC(CC)O[C....
9 4KS4 Ki = 72 nM 1SN C19 H30 N4 O5 CC[C@H](c1....
10 4KS1 Kd = 1.5 nM 2H8 C14 H24 N2 O4 CCC(CC)O[C....
11 4MJU - 27S C16 H23 N3 O5 S CCC(CC)O[C....
12 2HT8 - G39 C14 H24 N2 O4 CCC(CC)O[C....
13 1F8E Ki = 15 uM 49A C11 H19 N3 O6 CC(=O)N[C@....
14 4MWW - G39 C14 H24 N2 O4 CCC(CC)O[C....
15 2QWG ic50 = 230 uM G28 C13 H23 N3 O5 CCN(CC)C(=....
16 1INY - EQP C10 H20 N O9 P CC(=O)N[C@....
17 1F8B Ki = 4 uM DAN C11 H17 N O8 CC(=O)N[C@....
18 1XOE ic50 = 41 nM ABX C14 H24 N2 O5 CC(C)C[C@@....
19 4MWX ic50 = 75.7 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
20 2QWC Ki = 280 uM DAN C11 H17 N O8 CC(=O)N[C@....
21 2QWJ ic50 = 0.23 uM G28 C13 H23 N3 O5 CCN(CC)C(=....
22 2QWI Ki = 2.16 uM G20 C14 H23 N5 O5 [H]/N=C(/N....
23 4MWY ic50 = 89.6 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
24 1L7G - BCZ C15 H28 N4 O4 CCC(CC)[C@....
25 1BJI ic50 = 0.002 uM DPC C20 H27 N3 O5 CCCN(CCc1c....
26 1F8D Ki = 400 uM 9AM C11 H18 N2 O7 CC(=O)N[C@....
27 2QWE Ki = 0.033 uM GNA C12 H22 N4 O7 CC(=O)N[C@....
28 4MWQ ic50 = 0.79 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
29 1NNC - ZMR C12 H20 N4 O7 CC(=O)N[C@....
30 4MX0 ic50 = 184.7 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
31 2QWB Ki = 1820 uM SIA C11 H19 N O9 CC(=O)N[C@....
32 2QWK ic50 = 0.002 uM G39 C14 H24 N2 O4 CCC(CC)O[C....
33 2QWF Ki = 2.16 uM G20 C14 H23 N5 O5 [H]/N=C(/N....
34 1MWE - SIA C11 H19 N O9 CC(=O)N[C@....
35 4MWR ic50 = 0.41 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
36 1L7F - BCZ C15 H28 N4 O4 CCC(CC)[C@....
37 1F8C Ki = 0.04 uM 4AM C11 H18 N2 O7 CC(=O)N[C@....
38 4MWU ic50 = 3.24 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
39 5JYY - 6PY C16 H27 N5 O9 [H]/N=C(N)....
40 2QWD Ki = 14 uM 4AM C11 H18 N2 O7 CC(=O)N[C@....
41 2QWH ic50 = 13 uM G39 C14 H24 N2 O4 CCC(CC)O[C....
42 4WEG - DF4 C11 H16 F N O8 CC(=O)N[C@....
43 4MWV ic50 = 0.4 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
44 4DGR ic50 = 4.4 uM 3LV C20 H30 N2 O5 CCCN(CCC)C....
45 1L7H - BCZ C15 H28 N4 O4 CCC(CC)[C@....
46 4GZP Ki = 14.3 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
47 4GZT Ki = 17 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
48 4GZX - SIA C11 H19 N O9 CC(=O)N[C@....
49 4GZW Kd = 30 uM NAG SIA GAL n/a n/a
50 4GZQ - SIA C11 H19 N O9 CC(=O)N[C@....
51 1INF ic50 = 10 uM ST4 C10 H14 N4 O3 CC(=O)Nc1c....
52 1B9T ic50 = 8 uM RAI C14 H18 N4 O5 c1cc(c(cc1....
53 1IVB - ST1 C9 H8 N2 O6 CC(=O)Nc1c....
54 1A4Q ic50 = 3.6 uM DPC C20 H27 N3 O5 CCCN(CCc1c....
55 1NSC - SIA C11 H19 N O9 CC(=O)N[C@....
56 1A4G ic50 = 0.004 uM ZMR C12 H20 N4 O7 CC(=O)N[C@....
57 1INV - EQP C10 H20 N O9 P CC(=O)N[C@....
58 1B9S ic50 = 667 uM FDI C15 H20 N2 O4 CCC(CC)C(=....
59 3K37 ic50 = 2.8 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
60 1VCJ ic50 = 26 uM IBA C18 H27 N3 O4 CCC(CC)Nc1....
61 1B9V ic50 = 224 uM RA2 C18 H26 N2 O5 CCC(CC)Nc1....
62 1NSD - DAN C11 H17 N O8 CC(=O)N[C@....
63 4H53 - SLB C11 H19 N O9 CC(=O)N[C@....
64 4K1I - G39 C14 H24 N2 O4 CCC(CC)O[C....
65 4K1J - G39 C14 H24 N2 O4 CCC(CC)O[C....
66 4K1K - G39 C14 H24 N2 O4 CCC(CC)O[C....
67 1ING - ST5 C11 H12 N2 O5 CC(=O)Nc1c....
68 1INH - ST6 C11 H14 N3 O4 CC(=O)Nc1c....
69 1IVF - DAN C11 H17 N O8 CC(=O)N[C@....
70 1IVE - ST3 C9 H10 N2 O3 CC(=O)Nc1c....
71 1INX - EQP C10 H20 N O9 P CC(=O)N[C@....
72 1INW - AXP C10 H20 N O9 P CC(=O)N[C@....
73 2BAT - SIA C11 H19 N O9 CC(=O)N[C@....
74 1IVC - ST2 C9 H10 N2 O4 CC(=O)Nc1c....
75 1IVD - ST1 C9 H8 N2 O6 CC(=O)Nc1c....
76 4QN6 - LNV C13 H22 N4 O7 [H]/N=C(N)....
77 4WA5 ic50 = 1.29 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
78 4WA4 ic50 = 0.66 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
79 4QN5 - SIA GAL n/a n/a
80 3SAN - ZMR C12 H20 N4 O7 CC(=O)N[C@....
81 3TI8 ic50 = 0.9 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
82 2HU4 - G39 C14 H24 N2 O4 CCC(CC)O[C....
83 3TI6 ic50 = 0.54 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
84 3TI3 ic50 = 1.83 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
85 3TI5 ic50 = 1.11 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
86 3CL0 Ki = 20.8 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
87 4B7R Ki = 0.23 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
88 3TI4 ic50 = 947 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
89 2HTY - NAG C8 H15 N O6 CC(=O)N[C@....
90 3CKZ Ki = 0.19 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
91 3B7E - ZMR C12 H20 N4 O7 CC(=O)N[C@....
92 4CPN - ZMR C12 H20 N4 O7 CC(=O)N[C@....
93 4CPY Ki = 491.35 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
94 4CPZ Ki = 20.85 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
95 4B7J Ki = 11.1 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
96 4QN7 ic50 = 0.84 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
97 3TIC ic50 = 1.36 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
98 3TIA ic50 = 3.12 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
99 3TIB ic50 = 129 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
100 4HZZ ic50 = 8.31 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
101 4I00 - ZMR C12 H20 N4 O7 CC(=O)N[C@....
102 4HZW ic50 = 1.31 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
103 4HZX ic50 = 0.5 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: G39; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 22N 1 1
2 G39 1 1
3 2H8 0.5 0.911111
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4HZX; Ligand: G39; Similar sites found: 397
This union binding pocket(no: 1) in the query (biounit: 4hzx.bio1) has 20 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3KPE TM3 0.001091 0.48318 None
2 2IYG FMN 0.002135 0.44108 None
3 3JQM GTP 0.009422 0.42292 None
4 2GJ3 FAD 0.0004906 0.4101 None
5 1Q3Q ANP 0.000001354 0.47189 1.03093
6 2PFC PLM 0.006759 0.42037 1.0929
7 2OHV NHL 0.01834 0.41019 1.13636
8 4KCT PYR 0.001711 0.45538 1.28866
9 1ZFJ IMP 0.00044 0.42613 1.28866
10 1GPJ CIT 0.01802 0.42451 1.28866
11 3HPF GAE 0.00005975 0.42217 1.28866
12 4KCT FDP 0.006133 0.42212 1.28866
13 3L6R MLI 0.03204 0.41738 1.44509
14 1O68 KIV 0.008579 0.42946 1.45455
15 1DXY COI 0.04195 0.42258 1.5015
16 3RKR NAP 0.01111 0.41141 1.52672
17 1ZED PNP 0.007528 0.44892 1.54639
18 1PX8 XYP 0.0075 0.43729 1.54639
19 4P87 4NP 0.0004839 0.42125 1.54639
20 3PIJ FRU 0.0156 0.40918 1.54639
21 1USR DAN 0.002984 0.40141 1.54639
22 1X8X TYR 0.01339 0.412 1.5528
23 4O8O AHR 0.002609 0.41759 1.5625
24 2RHQ GAX 0.003353 0.40647 1.70068
25 3DER ALA LYS 0.00166 0.41706 1.73913
26 1K27 MTM 0.00006493 0.43078 1.76678
27 2QV7 ADP 0.0006367 0.45269 1.78042
28 4QVH FLC 0.01376 0.46697 1.80412
29 1H16 PYR 0.01522 0.43974 1.80412
30 4UAL 3FV 0.002568 0.42491 1.80412
31 2I4O ATP 0.006874 0.42436 1.80412
32 1JIL 485 0.001936 0.42183 1.80412
33 1Y9G FRU 0.01717 0.40706 1.80412
34 3MTW M3R 0.01222 0.40237 1.80412
35 1D3V ABH 0.00006705 0.4524 1.85759
36 3VGL ANP 0.00008257 0.41257 1.86916
37 2R5T ANP 0.001806 0.41928 1.87668
38 1LTH FBP 0.000071 0.54019 1.88088
39 1LTH OXM 0.0007338 0.46568 1.88088
40 4TSK NDP 0.0004191 0.40544 2
41 3CEV ARG 0.02263 0.40615 2.00669
42 3LST SAH 0.007786 0.41384 2.01149
43 2HW1 FRU 0.006236 0.44103 2.01342
44 1WCQ DAN 0.002068 0.45362 2.06186
45 4LIT AKG 0.007559 0.43714 2.06186
46 1Y42 TYR 0.01725 0.41571 2.06186
47 2QS8 MET 0.0004963 0.41449 2.06186
48 4MOB ADP 0.006531 0.41121 2.10843
49 3FPZ AHZ 0.0004129 0.41876 2.14724
50 3DG6 MUC 0.01168 0.40672 2.17984
51 1JA9 NDP 0.0002249 0.42065 2.18978
52 1JA9 PYQ 0.000008544 0.41054 2.18978
53 1A8S PPI 0.01689 0.40574 2.1978
54 3L02 CP 0.0005656 0.40402 2.22841
55 3L02 SN0 0.0005656 0.40402 2.22841
56 1SQ5 PAU 0.01521 0.41819 2.27273
57 2WL9 MBD 0.00003275 0.46684 2.29508
58 2NZ2 CIR 0.00000575 0.48216 2.31959
59 2NZ2 ASP 0.001081 0.47007 2.31959
60 4M2K PLP 0.008798 0.42422 2.31959
61 2IZ1 ATR 0.01906 0.42333 2.31959
62 1HV9 UD1 0.000125 0.42268 2.31959
63 3PLN U5P 0.02358 0.40953 2.31959
64 3I0O SMI 0.003435 0.4531 2.35988
65 3LIH RAF 0.002039 0.42478 2.36593
66 1RZM PEP 0.01155 0.42361 2.36686
67 1Z6K OAA 0.003675 0.4336 2.38908
68 4BCS BTN 0.01171 0.40309 2.4
69 1G7V PAI 0.00001157 0.42816 2.46479
70 2V9M CIT 0.0001089 0.50086 2.55474
71 2ZO9 MLI 0.002675 0.43938 2.55474
72 2Y0I AKG 0.02544 0.41245 2.55682
73 3IB9 BTN 0.001093 0.49466 2.57732
74 2PP3 LGT 0.00007609 0.44475 2.57732
75 1P9B GDP 0.003655 0.41905 2.57732
76 4WBD ADP 0.03196 0.41743 2.57732
77 2Q09 DI6 0.01303 0.41672 2.57732
78 3NKS ACJ 0.005815 0.41504 2.57732
79 1P9B HDA 0.04041 0.40296 2.57732
80 1H2K OGA 0.009418 0.43813 2.5788
81 3P3N AKG 0.02064 0.42164 2.5788
82 4B7E OGA 0.03791 0.40427 2.5788
83 3TFC PEP 0.008311 0.43008 2.5974
84 4Q3S X7A 0.002262 0.40296 2.5974
85 4Q3R XA2 0.002652 0.40072 2.5974
86 1Y7I SAL 0.01154 0.42363 2.61194
87 3DGB MUC 0.01313 0.40841 2.6178
88 1FS5 TLA 0.001636 0.40303 2.63158
89 2GGH NLQ 0.00008218 0.41263 2.66667
90 3SHR CMP 0.004971 0.43035 2.67559
91 1CKM GTP 0.01813 0.4104 2.72727
92 1CKN GTP 0.02164 0.40701 2.72727
93 2PYU IMP 0.03502 0.4059 2.73973
94 4N69 SER 0.02539 0.41728 2.7972
95 3L24 GOA 0.001784 0.49655 2.83505
96 1JQN DCO 0.00001604 0.44443 2.83505
97 4WVH ASP HIS ASP ALA HIS ALA 0.004846 0.43559 2.83505
98 1GJW GLC 0.01491 0.43408 2.83505
99 2W8Q SIN 0.01733 0.43081 2.83505
100 1GJW MAL 0.005758 0.42763 2.83505
101 1UOU CMU 0.004248 0.42444 2.83505
102 1KWK GAL 0.002206 0.42351 2.83505
103 4QDC ASD 0.0003882 0.42259 2.83505
104 4LHM AZZ 0.02064 0.41672 2.83505
105 4HPP GLU 0.0002199 0.40702 2.83505
106 4A38 BZS 0.02044 0.40476 2.83505
107 3WN0 FUB 0.003707 0.40464 2.83505
108 3VOZ 04A 0.0005985 0.44906 2.85714
109 2VAR AMP 0.01919 0.40531 2.8754
110 1JGS SAL 0.04903 0.43246 2.89855
111 2TOH HBI 0.00001948 0.4743 2.91545
112 2FGQ MLT 0.009284 0.43843 3.01205
113 4B4D FAD 0.005128 0.40319 3.05344
114 2Q3M MLA 0.04274 0.42213 3.06748
115 3PMA SCR 0.01322 0.42096 3.0888
116 3IHB GLU 0.0115 0.43972 3.09278
117 1Z4V DAN 0.001979 0.43881 3.09278
118 3QV9 QV7 0.009228 0.43309 3.09278
119 2Z5Y HRM 0.0001793 0.42789 3.09278
120 1K6M AGS 0.001858 0.41536 3.09278
121 2F2U M77 0.02473 0.40058 3.09278
122 4M7F BM3 0.000369 0.4911 3.09735
123 2X61 CH 0.00006073 0.41034 3.10078
124 1PEA ACM 0.0162 0.43833 3.11688
125 1Y9Q MED 0.02243 0.4199 3.125
126 4CML 52N 0.001825 0.40155 3.19489
127 2GN2 C5P 0.00005336 0.48911 3.21637
128 3PNA CMP 0.01595 0.41286 3.24675
129 4HE2 AMP 0.00001833 0.45012 3.25444
130 2P69 PLP 0.01709 0.42057 3.26797
131 1I0Z OXM 0.01884 0.44149 3.3033
132 3UDG TMP 0.004182 0.47669 3.32226
133 3CBG 4FE 0.001484 0.5107 3.35052
134 1KC7 PPR 0.002525 0.47256 3.35052
135 2YP9 SIA CMO 0.0007294 0.44805 3.35052
136 2BF6 SIA 0.002875 0.43596 3.35052
137 4CIB 7UZ 0.01225 0.42734 3.35052
138 1V8K ANP 0.0002191 0.41881 3.35052
139 2Z9V PXM 0.01953 0.41325 3.35052
140 1MVQ MMA 0.0002328 0.41805 3.38983
141 1F1V DHY 0.01393 0.41546 3.40557
142 2QCX PF1 0.01471 0.42362 3.42205
143 3UEC ALA ARG TPO LYS 0.01805 0.42992 3.42466
144 1T3D CYS 0.03727 0.41406 3.46021
145 2VQ5 LDP 0.009065 0.45863 3.48259
146 4BT5 23B 0.02451 0.40462 3.50195
147 2OFE NAG 0.002431 0.46645 3.52113
148 2BLE 5GP 0.00006517 0.42882 3.54223
149 1FX8 BOG 0.00712 0.40797 3.55872
150 2BZ1 TAU 0.004204 0.49541 3.57143
151 1EYE PMM 0.003079 0.43451 3.57143
152 1WRA PC 0.01594 0.43263 3.57143
153 2R00 OEG 0.02243 0.42519 3.57143
154 1FA2 DOM 0.0001136 0.4339 3.60825
155 4HA6 PXM 0.01018 0.43109 3.60825
156 3A2Q ACA ACA 0.005198 0.4132 3.60825
157 1E4I NFG 0.001499 0.4057 3.60825
158 2HGS GSH 0.01251 0.40552 3.60825
159 3A1I UNU 0.02066 0.40393 3.60825
160 2NVK NAP 0.03293 0.4029 3.60825
161 1YBQ BDH 0.0003566 0.40139 3.60825
162 9LDT OXM 0.008962 0.46697 3.61446
163 1LDM OXM 0.00007157 0.50861 3.64742
164 4B9E FAH 0.00746 0.44911 3.65448
165 3I8T LBT 0.00003619 0.53653 3.65854
166 2ZI8 SDT 0.00007086 0.44011 3.66667
167 3WUD GLC GAL 0.03583 0.42033 3.67647
168 1V2G OCA 0.01125 0.41119 3.68421
169 5DSC GLY 5CT GLY SER GLY 0.02593 0.41937 3.72093
170 1JOT GAL A2G 0.0003758 0.47802 3.7594
171 3OIG IMJ 0.0002939 0.40921 3.7594
172 1UGX GAL MGC 0.001302 0.40179 3.7594
173 3NOJ PYR 0.0003181 0.49752 3.78151
174 1FNZ A2G 0.0001192 0.45666 3.79747
175 4AF0 MOA 0.00009809 0.45107 3.86598
176 4QDF 30Q 0.0001139 0.43927 3.86598
177 1Z45 GAL 0.01911 0.41369 3.86598
178 3W8S GSH 0.003359 0.45355 3.8835
179 3SQG COM 0.002308 0.49997 3.94265
180 1QDS PGA 0.01087 0.41587 3.98406
181 1ULE GLA GAL NAG 0.02648 0.42722 4
182 3D3H M4O 0.009346 0.40695 4
183 3S2Y FMN 0.005928 0.4075 4.0201
184 3TKA CTN 0.001988 0.51104 4.03458
185 3SCH TB6 0.01184 0.43333 4.0404
186 1ZZ7 S0H 0.01186 0.4231 4.0404
187 3NNF AKG 0.03992 0.40768 4.06977
188 3NKT 1HN 0.001121 0.4097 4.07609
189 1W0O DAN 0.00004722 0.51462 4.12371
190 3JDW ORN 0.00174 0.43559 4.12371
191 2VW1 DAN 0.001891 0.42858 4.12371
192 4F8L GAL 0.008668 0.47698 4.13793
193 1Z42 HBA 0.008067 0.47891 4.14201
194 1Z41 FMN 0.00199 0.4333 4.14201
195 1Z48 FMN 0.006126 0.41416 4.14201
196 1B55 4IP 0.01294 0.40492 4.14201
197 3U1T MLI 0.03982 0.4126 4.20712
198 3LTW HLZ 0.04996 0.40289 4.28571
199 3P7I P7I 0.01184 0.42313 4.36137
200 3B9Z CO2 0.0004554 0.50141 4.38144
201 2HXT EHM 0.003503 0.42781 4.38144
202 2ADD SUC 0.01411 0.41139 4.38144
203 1GSA ADP 0.003789 0.40463 4.43038
204 1OMZ UD2 0.000003098 0.44798 4.43686
205 4N02 FNR 0.000003695 0.45589 4.48179
206 2EB5 OXL 0.004421 0.45396 4.49438
207 1ML4 PAL 0.0001502 0.44695 4.54545
208 1QW9 KHP 0.00007824 0.45023 4.63918
209 2C5S AMP 0.002305 0.44972 4.63918
210 1T0S BML 0.01785 0.43615 4.63918
211 1LCP PLU 0.0005263 0.42345 4.63918
212 3O2K DST 0.02468 0.40863 4.63918
213 2BTO GTP 0.0001732 0.40165 4.63918
214 3W2W ATP 0.0174 0.40331 4.65839
215 1HQL GLA MBG 0.00397 0.46277 4.66926
216 1II5 GLU 0.003646 0.45189 4.72103
217 4INB 1F6 0.004981 0.4069 4.79452
218 3O03 GCO 0.001102 0.50778 4.811
219 2JFV FLC 0.008041 0.44144 4.811
220 4FGC PQ0 0.02623 0.41183 4.84848
221 1B5E DCM 0.01503 0.41399 4.87805
222 3MAG 3MA 0.04809 0.42572 4.88599
223 3VCA PRO 0.01271 0.42412 4.89691
224 2WVZ KIF 0.009442 0.40703 4.89691
225 1NXJ TLA 0.0001543 0.47412 4.91803
226 1NXJ GLV 0.001104 0.46371 4.91803
227 1XE7 GUN 0.01691 0.44403 4.92611
228 1EUS DAN 0.001524 0.46033 4.93151
229 3IL6 B83 0.007346 0.40076 4.98442
230 3K3G MMU 0.001264 0.47009 5
231 1C1E ENH 0.02931 0.40956 5.02283
232 3MCT 3MC 0.003458 0.44729 5.05051
233 3H22 B53 0.005237 0.42939 5.05051
234 2DWU DGL 0.01252 0.41749 5.07246
235 1P72 THM 0.00854 0.42955 5.08982
236 1Q6O LG6 0.003292 0.42474 5.09259
237 1QO0 BMD 0.01956 0.42278 5.10204
238 1AUX AGS 0.008954 0.40416 5.14469
239 1F7K UMP 0.001541 0.40385 5.14706
240 3CXO 1N5 0.000002795 0.47386 5.15464
241 3CXO 3LR 0.0000177 0.45837 5.15464
242 4IVG ANP 0.000002403 0.41368 5.15464
243 2YD6 FLC 0.008226 0.47612 5.18868
244 4NAO AKG 0.04969 0.40771 5.21472
245 1QR0 COA 0.01386 0.41136 5.26316
246 4LKK SIA GAL 0.0008745 0.43847 5.41401
247 2JE7 XMM 0.00003828 0.45611 5.43933
248 2ZE3 AKG 0.01121 0.42914 5.45455
249 3V91 UPG 0.000004536 0.41252 5.49828
250 1N9L FMN 0.001269 0.43245 5.50459
251 1B4P GPS 0.004733 0.41115 5.52995
252 3DX5 DHB 0.005919 0.42712 5.59441
253 4G1V FAD 0.00007044 0.44884 5.6701
254 1O7N IND 0.001021 0.42437 5.6701
255 1C7S CBS 0.01656 0.40421 5.6701
256 2CW6 3HG 0.01705 0.44383 5.7047
257 4NVP 7CH 0.000003791 0.45425 5.74163
258 2X2T GAL NGA 0.01127 0.45354 5.88235
259 1V7R CIT 0.02454 0.44234 5.91398
260 4A8H PUW 0.0003001 0.41637 5.91549
261 1TV5 ORO 0.001624 0.43461 5.92783
262 1TV5 A26 0.001228 0.42159 5.92783
263 2C9O ADP 0.000165 0.41925 5.92783
264 2ZJ5 ADP 0.03043 0.40879 5.92783
265 3S9K CIT 0.001484 0.54646 5.9322
266 2CCV A2G 0.001576 0.40804 5.94059
267 1GVF PGH 0.01026 0.42594 5.94406
268 2JAR UMP 0.008622 0.40143 6
269 1EB9 HBA 0.005255 0.4249 6.10687
270 3E5H GNP 0.002307 0.4057 6.17978
271 4ME6 ADP 0.01506 0.42314 6.21762
272 3SVL FMN 0.008831 0.40439 6.21762
273 2VMD MBG 0.0403 0.42353 6.22568
274 1OTH PAO 0.0001199 0.42319 6.23053
275 1CBF SAH 0.01098 0.4042 6.31579
276 2OWZ CIT 0.0001154 0.45715 6.3253
277 1A5V Y3 0.03731 0.4046 6.32911
278 3EYK EYK 0.003424 0.4593 6.39535
279 1NPL MAN 0.005 0.45139 6.42202
280 1H8P PC 0.01462 0.44744 6.42202
281 4OYA 1VE 0.0007973 0.41959 6.4433
282 1MS9 LAT 0.004617 0.41334 6.4433
283 2BGM NAJ 0.0004997 0.4034 6.47482
284 1WKL ATP 0.0001113 0.47179 6.56934
285 1WKL ADP 0.0000364 0.41011 6.56934
286 2D4N DUP 0.002573 0.40567 6.57895
287 1WHT BZS 0.03076 0.41322 6.64062
288 3W54 RNB 0.01546 0.4018 6.68693
289 4SLI CNP 0.003565 0.40678 6.70103
290 2SIM DAN 0.005874 0.4167 6.82415
291 4Q3F TLA 0.00575 0.44846 6.83761
292 1XVA SAM 0.004103 0.40997 6.84932
293 1OGD RIP 0.02581 0.40774 6.87023
294 3R51 MMA 0.02824 0.43196 6.875
295 1TH8 ADP 0.01776 0.40675 6.89655
296 4AP9 1PS 0.001448 0.42641 6.96517
297 3UIE ADX 0.005658 0.41943 7
298 4TMK T5A 0.0001481 0.44583 7.04225
299 4DN8 BMA 0.0002411 0.51468 7.05128
300 4C25 13P 0.0001593 0.42945 7.07547
301 1N6B DMZ 0.0000004838 0.47002 7.2165
302 3ZGE ASP 0.004975 0.46489 7.2165
303 2IMP LAC 0.0001544 0.46171 7.2165
304 1P1M MET 0.002766 0.40937 7.2165
305 2Y7P SAL 0.03087 0.40419 7.33945
306 3KJQ B94 0.01782 0.40288 7.36842
307 1RYD GLC 0.01042 0.43601 7.49354
308 1A5Z OXM 0.0001137 0.54955 7.52351
309 1A5Z FBP 0.001211 0.42923 7.52351
310 3I7S PYR 0.01212 0.44487 7.53425
311 3UXL CFI 0.00002733 0.41315 7.5718
312 2BJF DXC 0.00001015 0.42294 7.59878
313 2ALG DAO 0.03983 0.40326 7.6087
314 4COQ SAN 0.03423 0.41095 7.69231
315 1VCO GLN 0.0001207 0.44033 7.73196
316 1R6W 164 0.008558 0.40845 7.76398
317 1YFZ IMP 0.02765 0.41075 7.80488
318 4LO6 SIA GAL 0.0003511 0.51964 7.89474
319 1KDK DHT 0.004399 0.40238 7.9096
320 2AZ3 CDP 0.03632 0.40095 7.92683
321 2V5K OXM 0.01992 0.40271 8.01394
322 4AQL TXC 0.008616 0.4048 8.24742
323 4N7U 2JA 0.01049 0.45522 8.42105
324 4A3R CIT 0.00004244 0.42615 8.50515
325 1HFA PIO 0.000093 0.63445 8.65052
326 4U36 TNR 0.0004202 0.43017 8.75
327 3UBW 6SP 0.001004 0.54888 8.81226
328 4FUA PGH 0.0009038 0.41266 8.83721
329 2NZU BG6 0.0124 0.42221 8.92857
330 4AF5 CIT 0.03821 0.40861 8.94737
331 2ZWS PLM 0.0485 0.43275 9.02062
332 1I1Q TRP 0.02555 0.40383 9.02062
333 1V1A KDG 0.0028 0.41425 9.06149
334 1V1A ADP 0.0005358 0.41348 9.06149
335 4N7C AEF 0.02038 0.42727 9.09091
336 2FH5 GTP 0.00002025 0.4099 9.18919
337 3ZZS TRP 0.00003775 0.42752 9.23077
338 3VPD BUA 0.01543 0.46164 9.25267
339 3VPD CIT 0.04753 0.42601 9.25267
340 3VPD ANP 0.005817 0.40124 9.25267
341 1NU4 MLA 0.001811 0.4543 9.27835
342 1C1L GAL BGC 0.01903 0.42877 9.48905
343 1NME 159 0.00001278 0.52582 9.58904
344 3CH5 GDP 0.0003448 0.40727 9.61539
345 2PNZ UDP 0.0001723 0.43914 9.63855
346 4RJK PYR 0.007943 0.47921 9.79381
347 2NCD ADP 0.005355 0.44412 9.79381
348 3EM1 TYD 0.0008808 0.42125 10.274
349 2OI2 DP6 0.01219 0.40975 10.274
350 4L7I SAM 0.006374 0.40981 10.3093
351 3NJQ NJQ 0.00004575 0.45366 10.3627
352 1FWE HAE 0.001054 0.46459 10.3774
353 1JAC AMG 0.03423 0.43414 10.5263
354 1H8G CHT 0.04735 0.43337 10.5263
355 3T2W BTN 0.007852 0.4219 10.6557
356 4NTX AMR 0.009782 0.42935 10.9244
357 4AIG FLX 0.01157 0.41471 10.9453
358 1Y75 NAG 0.01087 0.42018 11.0169
359 2O66 FLC 0.02314 0.41439 11.1111
360 1V6A TRE 0.04302 0.40167 11.1446
361 3EJ0 11X 0.0007656 0.41819 11.2245
362 4K30 NLG 0.009173 0.42814 11.25
363 1UJ5 5RP 0.01449 0.40662 11.4537
364 1C3M MAN MAN 0.001294 0.44521 11.5646
365 3V0W PA1 GLC GLC GLC GM0 GLA GM0 GMH KDO KDO 0.02908 0.44194 12.3288
366 2FR6 CTN 0.003693 0.41517 12.3288
367 1SC3 MLI 0.008724 0.45228 12.5
368 43CA NPO 0.01434 0.4676 12.8205
369 1C3V PDC 0.009793 0.43188 13.0612
370 2YA8 G39 0.003759 0.41344 13.1443
371 1Y7P RIP 0.03338 0.42195 13.4529
372 3TA2 AKG 0.0006953 0.41005 13.5593
373 3M0J OAF 0.0001423 0.42426 13.6808
374 1NP0 NGT 0.01904 0.42335 13.7931
375 2QLX RM4 0.01955 0.42818 13.8889
376 4PNO U5P 0.007895 0.41359 13.8889
377 4IEN COA 0.0004829 0.40183 14.1104
378 2BOI MFU 0.0309 0.40416 14.1593
379 3F81 STT 0.001584 0.49932 14.7541
380 5A2J ALA PRO ASP THR ARG PRO 0.01554 0.44255 14.7541
381 3GD8 BOG 0.000000191 0.69262 15.6951
382 3GD8 GOL 0.0003185 0.43416 15.6951
383 3K5X P8D 0.01337 0.41203 15.7216
384 3QDV NDG 0.003209 0.46738 16.0839
385 3QDY CBS 0.008038 0.4475 16.0839
386 3QDV A2G 0.01799 0.44258 16.0839
387 3QDW NDG 0.01211 0.43861 16.0839
388 3QDW A2G 0.034 0.42757 16.0839
389 3QDT A2G GAL 0.02663 0.42709 16.0839
390 2JBH 5GP 0.003659 0.44093 17.3333
391 4BPM GSH 0.0004358 0.4261 17.9775
392 1GU3 BGC BGC BGC BGC BGC 0.03241 0.40322 18.7919
393 1PTR PRB 0.02079 0.42684 20
394 4CCO OGA 0.0257 0.40782 20
395 2HVK TBA 0.02035 0.42195 20.283
396 1XX4 BAM 0.001096 0.47293 21.0728
397 4CCN OGA 0.01583 0.42723 22.8571
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