Receptor
PDB id Resolution Class Description Source Keywords
1JQ9 1.8 Å EC: 3.1.1.4 CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN PHOSPHOLIPASE DABOIA RUSSELLI PULCHELLA AND A DESIGNED PENTAPEPTIDE PHE-LT YR-LYS AT 1.8 RESOLUTION DABOIA RUSSELLII PULCHELLA PHOSPHOLIPASE A2 DABOIA RUSSELLI PULCHELLA NEUROTOXIC DESPEPTIDE HYDROLASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN A SNA PHOSPHOLIPASE A2 AND A POTENT PEPTIDE INHIBITOR PHE-LEU-SER-TYR-LYS AT 1.8 A RESOLUTION J.BIOL.CHEM. V. 277 41079 2002
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACY A:301;
A:302;
A:304;
B:303;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
60.052 C2 H4 O2 CC(=O...
PHE LEU SER TYR LYS P:1;
Valid;
none;
Kd = 3.57 nM
657.789 n/a O=C([...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1JQ9 1.8 Å EC: 3.1.1.4 CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN PHOSPHOLIPASE DABOIA RUSSELLI PULCHELLA AND A DESIGNED PENTAPEPTIDE PHE-LT YR-LYS AT 1.8 RESOLUTION DABOIA RUSSELLII PULCHELLA PHOSPHOLIPASE A2 DABOIA RUSSELLI PULCHELLA NEUROTOXIC DESPEPTIDE HYDROLASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: CRYSTAL STRUCTURE OF A COMPLEX FORMED BETWEEN A SNA PHOSPHOLIPASE A2 AND A POTENT PEPTIDE INHIBITOR PHE-LEU-SER-TYR-LYS AT 1.8 A RESOLUTION J.BIOL.CHEM. V. 277 41079 2002
Members (26)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 14 families.
1 2QVD Kd = 0.00000145 M BER C20 H18 N O4 COc1ccc2cc....
2 1ZWP - NIM C13 H12 N2 O5 S CS(=O)(=O)....
3 1OXL - IDA C15 H18 N2 O3 CCCc1cc2cc....
4 1TG4 - PHE LEU ALA TYR LYS n/a n/a
5 1SKG - VAL ALA PHE ARG SER n/a n/a
6 1JQ9 Kd = 3.57 nM PHE LEU SER TYR LYS n/a n/a
7 2ARM Ki = 7.4 nM OIN C17 H23 N O3 CN1[C@H]2C....
8 1FV0 Kd = 1.18 uM 9AR C17 H11 N O8 COc1c(ccc2....
9 1Q7A Kd = 0.064 uM OPB C19 H20 N2 O3 CCCC[C@H]1....
10 1TG1 - PHQ LEU VAL ARG TYR n/a n/a
11 1ZYX - LCF C23 H22 Cl N O2 CC1(Cc2c(c....
12 1TJK - PHE LEU SER THR LYS n/a n/a
13 1KPM Ki = 1.59 uM VIT C29 H50 O2 Cc1c(c2c(c....
14 1TP2 - TDA C13 H26 O2 CCCCCCCCCC....
15 1TDV - TYR TRP ALA ALA ALA ALA n/a n/a
16 1TJ9 - VAL ALA ARG SER n/a n/a
17 1JQ8 Ki = 1.01 uM LEU ALA ILE TYR SER n/a n/a
18 1SQZ - PHQ ILE ALA ARG SER n/a n/a
19 1TGM - AIN C9 H8 O4 CC(=O)Oc1c....
20 1ZR8 - AJM C18 H22 N2 O2 C[N@]1c2cc....
21 1TH6 - OIN C17 H23 N O3 CN1[C@H]2C....
22 1Y38 - G3P C3 H9 O6 P C([C@H](CO....
23 3H1X Kd = 0.00000145 M IMN C19 H16 Cl N O4 Cc1c(c2cc(....
24 1SXK - BHA C7 H7 N O3 c1cc(c(cc1....
25 1TK4 - ALA ILE ARG SER n/a n/a
26 1SV3 - ANN C8 H8 O3 COc1ccc(cc....
70% Homology Family (28)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 2QVD Kd = 0.00000145 M BER C20 H18 N O4 COc1ccc2cc....
2 1ZWP - NIM C13 H12 N2 O5 S CS(=O)(=O)....
3 1OXL - IDA C15 H18 N2 O3 CCCc1cc2cc....
4 1TG4 - PHE LEU ALA TYR LYS n/a n/a
5 1SKG - VAL ALA PHE ARG SER n/a n/a
6 1JQ9 Kd = 3.57 nM PHE LEU SER TYR LYS n/a n/a
7 2ARM Ki = 7.4 nM OIN C17 H23 N O3 CN1[C@H]2C....
8 1FV0 Kd = 1.18 uM 9AR C17 H11 N O8 COc1c(ccc2....
9 1Q7A Kd = 0.064 uM OPB C19 H20 N2 O3 CCCC[C@H]1....
10 1TG1 - PHQ LEU VAL ARG TYR n/a n/a
11 1ZYX - LCF C23 H22 Cl N O2 CC1(Cc2c(c....
12 1TJK - PHE LEU SER THR LYS n/a n/a
13 1KPM Ki = 1.59 uM VIT C29 H50 O2 Cc1c(c2c(c....
14 1TP2 - TDA C13 H26 O2 CCCCCCCCCC....
15 1TDV - TYR TRP ALA ALA ALA ALA n/a n/a
16 1TJ9 - VAL ALA ARG SER n/a n/a
17 1JQ8 Ki = 1.01 uM LEU ALA ILE TYR SER n/a n/a
18 1SQZ - PHQ ILE ALA ARG SER n/a n/a
19 1TGM - AIN C9 H8 O4 CC(=O)Oc1c....
20 1ZR8 - AJM C18 H22 N2 O2 C[N@]1c2cc....
21 1TH6 - OIN C17 H23 N O3 CN1[C@H]2C....
22 1Y38 - G3P C3 H9 O6 P C([C@H](CO....
23 3H1X Kd = 0.00000145 M IMN C19 H16 Cl N O4 Cc1c(c2cc(....
24 1SXK - BHA C7 H7 N O3 c1cc(c(cc1....
25 1TK4 - ALA ILE ARG SER n/a n/a
26 1SV3 - ANN C8 H8 O3 COc1ccc(cc....
27 2QHD - DAO C12 H24 O2 CCCCCCCCCC....
28 3BJW - SVR C51 H40 N6 O23 S6 Cc1ccc(cc1....
50% Homology Family (68)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 1U4J - MAN C6 H12 O6 C([C@@H]1[....
2 1FDK - GLE C16 H32 F3 O6 P CCCCCCCCCC....
3 1MKV - GEL C20 H45 N O8 P2 CCCCCCCCOC....
4 2B96 - ANN C8 H8 O3 COc1ccc(cc....
5 4YU7 - DHC C9 H8 O4 c1cc(c(cc1....
6 3MLM - MYR C14 H28 O2 CCCCCCCCCC....
7 3CXI - VIT C29 H50 O2 Cc1c(c2c(c....
8 1XXS - STE C18 H36 O2 CCCCCCCCCC....
9 3CYL - VIT C29 H50 O2 Cc1c(c2c(c....
10 4YV5 Kd = 6.2 uM SVR C51 H40 N6 O23 S6 Cc1ccc(cc1....
11 4YZ7 - 9AR C17 H11 N O8 COc1c(ccc2....
12 3QNL - ROA C18 H16 O8 c1cc(c(cc1....
13 1Y4L - SVR C51 H40 N6 O23 S6 Cc1ccc(cc1....
14 2AZY - CHD C24 H40 O5 C[C@H](CCC....
15 1HN4 Kd = 0.15 mM MJI C22 H44 F3 O6 P CCCCCCCCCC....
16 2B01 - TUD C26 H45 N O6 S C[C@H](CCC....
17 1Y6O - MJI C22 H44 F3 O6 P CCCCCCCCCC....
18 2AZZ - TCH C26 H45 N O7 S C[C@H](CCC....
19 2B04 - CHO C26 H43 N O5 C[C@H](CCC....
20 2B00 - GCH C26 H43 N O6 C[C@H](CCC....
21 5P2P - DHG C20 H42 N O6 P CCCCCCCCCC....
22 3O4M - CAQ C6 H6 O2 c1ccc(c(c1....
23 2B03 - TUD C26 H45 N O6 S C[C@H](CCC....
24 1L8S - LPE C26 H57 N O6 P CCCCCCCCCC....
25 1FXF - MJI C22 H44 F3 O6 P CCCCCCCCCC....
26 1FX9 - MJI C22 H44 F3 O6 P CCCCCCCCCC....
27 3QLM Ki = 15.8 uM PLM C16 H32 O2 CCCCCCCCCC....
28 1POE - GEL C20 H45 N O8 P2 CCCCCCCCOC....
29 1DB4 - 8IN C21 H25 N2 O5 P Cc1c(c2cc(....
30 1KQU - BR4 C25 H33 N O3 c1ccc(cc1)....
31 5G3N ic50 = 0.012 uM X28 C23 H21 N O3 c1ccc(cc1)....
32 1KVO ic50 = 0.013 uM OAP C31 H37 N O3 S c1ccc(cc1)....
33 1J1A ic50 = 0.029 uM BHP C31 H37 N O4 c1ccc(cc1)....
34 4UY1 ic50 = 20 uM TJM C10 H11 N3 O S Cc1cc(c(s1....
35 5G3M ic50 = 24 uM 9JH C14 H13 N O c1ccc(cc1)....
36 2QVD Kd = 0.00000145 M BER C20 H18 N O4 COc1ccc2cc....
37 1ZWP - NIM C13 H12 N2 O5 S CS(=O)(=O)....
38 1OXL - IDA C15 H18 N2 O3 CCCc1cc2cc....
39 1TG4 - PHE LEU ALA TYR LYS n/a n/a
40 1SKG - VAL ALA PHE ARG SER n/a n/a
41 1JQ9 Kd = 3.57 nM PHE LEU SER TYR LYS n/a n/a
42 2ARM Ki = 7.4 nM OIN C17 H23 N O3 CN1[C@H]2C....
43 1FV0 Kd = 1.18 uM 9AR C17 H11 N O8 COc1c(ccc2....
44 1Q7A Kd = 0.064 uM OPB C19 H20 N2 O3 CCCC[C@H]1....
45 1TG1 - PHQ LEU VAL ARG TYR n/a n/a
46 1ZYX - LCF C23 H22 Cl N O2 CC1(Cc2c(c....
47 1TJK - PHE LEU SER THR LYS n/a n/a
48 1KPM Ki = 1.59 uM VIT C29 H50 O2 Cc1c(c2c(c....
49 1TDV - TYR TRP ALA ALA ALA ALA n/a n/a
50 1TJ9 - VAL ALA ARG SER n/a n/a
51 1JQ8 Ki = 1.01 uM LEU ALA ILE TYR SER n/a n/a
52 1SQZ - PHQ ILE ALA ARG SER n/a n/a
53 1TGM - AIN C9 H8 O4 CC(=O)Oc1c....
54 1ZR8 - AJM C18 H22 N2 O2 C[N@]1c2cc....
55 1TH6 - OIN C17 H23 N O3 CN1[C@H]2C....
56 1Y38 - G3P C3 H9 O6 P C([C@H](CO....
57 3H1X Kd = 0.00000145 M IMN C19 H16 Cl N O4 Cc1c(c2cc(....
58 1SXK - BHA C7 H7 N O3 c1cc(c(cc1....
59 1TK4 - ALA ILE ARG SER n/a n/a
60 1SV3 - ANN C8 H8 O3 COc1ccc(cc....
61 2QHD - DAO C12 H24 O2 CCCCCCCCCC....
62 3BJW - SVR C51 H40 N6 O23 S6 Cc1ccc(cc1....
63 1S8G - DAO C12 H24 O2 CCCCCCCCCC....
64 1POB - GEL C20 H45 N O8 P2 CCCCCCCCOC....
65 1TD7 Kd = 43 uM NFL C13 H9 F3 N2 O2 c1cc(cc(c1....
66 1OXR Kd = 0.00000145 M AIN C9 H8 O4 CC(=O)Oc1c....
67 2WQ5 Kd = 180 uM MIY C23 H27 N3 O7 CN(C)c1ccc....
68 1MF4 Ki = 10.2 nM VAL ALA PHE ARG SER n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PHE LEU SER TYR LYS; Similar ligands found: 173
No: Ligand ECFP6 Tc MDL keys Tc
1 PHE LEU SER TYR LYS 1 1
2 PHE LEU ALA TYR LYS 0.824176 0.903846
3 PHE LEU GLU LYS 0.655914 0.754717
4 TYR GLN SER LYS LEU 0.62 0.925926
5 LYS TYR LYS 0.609195 0.773585
6 GLU GLN TYR LYS PHE TYR SER VAL 0.590909 0.927273
7 LYS ALC LYS 0.586207 0.679245
8 GLU ASN LEU TYR PHE GLN 0.584906 0.836364
9 TYR GLU LEU ASP GLU LYS PHE ASP ARG LEU 0.578512 0.790323
10 PHE TYR ARG ALA LEU MET 0.577586 0.746032
11 GLU LEU ASP LYS TYR ALA SER 0.567568 0.907407
12 PHE ARG TYR LEU GLY 0.563636 0.770492
13 PHE LEU SER THR LYS 0.557692 0.867925
14 THR LYS ASN TYR LYS GLN PHE SER VAL 0.557522 0.910714
15 GLY ASN TYR SER PHE TYR ALA LEU 0.554545 0.842105
16 GLU ASN PRO THR TYR LYS PHE PHE GLU GLN 0.541284 0.854545
17 THR TYR LYS PHE PHE GLU GLN 0.541284 0.854545
18 GLY LEU MET TRP LEU SER TYR PHE VAL 0.530769 0.78125
19 ALA ALA SER LEU TYR GLU LYS LYS ALA ALA 0.530435 0.925926
20 GLU LEU ARG ARG LYS MET MET TYR MET 0.529915 0.69697
21 SER SER LEU GLU ASN PHE ALA ALA TYR VAL 0.528 0.875
22 PHE LEU ARG GLY ARG ALA TYR GLY LEU 0.52459 0.758065
23 GLU THR LEU LEU ASP LEU ASP PHE LEU GLU 0.524272 0.685185
24 GLU ASN GLN LYS GLU TYR PHE PHE 0.522523 0.785714
25 LYS ALA LEU TYR ASN PHE ALA THR MET 0.519685 0.833333
26 SER GLN TYR TYR TYR ASN SER LEU 0.518519 0.875
27 GLY ASN PHE LEU GLN SER ARG 0.512605 0.714286
28 SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.507812 0.862069
29 PHE LEU ARG GLY ARG ALA TYR VAL LEU 0.507692 0.758065
30 TYR GLY GLY PHE LEU 0.504673 0.851852
31 GLY LEU TYR ALA SER LYS LEU ALA 0.504505 0.907407
32 TYR GLN PHE 0.5 0.722222
33 LYS LEU LYS 0.5 0.698113
34 TYR LEU PHE VAL GLN ARG ASP SER LYS GLU 0.5 0.730769
35 LEU LEU TYR GLY PHE VAL ASN TYR VAL 0.495935 0.839286
36 GLY GLY LYS LYS LYS TYR LYS LEU 0.495327 0.836364
37 SER GLU ASP GLU PHE TYR ASP ALA LEU SER 0.491935 0.907407
38 ALA LEU ASP LEU PHE 0.489362 0.660377
39 CYS THR GLU LEU LYS LEU SER ASP TYR 0.488 0.909091
40 GLU GLU TYR LEU GLN ALA PHE THR TYR 0.488 0.87037
41 SER LEU TYR LEU THR VAL ALA THR LEU 0.486726 0.849057
42 LYS VAL LEU PHE LEU ASP GLY 0.486726 0.777778
43 MET LEU ILE TYR SER MET TRP GLY LYS 0.486111 0.787879
44 THR GLU ASN LEU TYR PHE GLN SER GLY THR 0.480916 0.894737
45 GLU GLU TYR LEU LYS ALA TRP THR PHE 0.478571 0.833333
46 SER VAL TYR ASP PHE PHE VAL TRP LEU 0.476562 0.8
47 LEU LEU TYR GLY PHE VAL ASN TYR ILE 0.476562 0.824561
48 GLU ASP GLU ASP PHE GLU ILE LEU SER LEU 0.475806 0.818182
49 THR LYS ASN TYR LYS GLN THR SER VAL 0.47541 0.859649
50 LYS LEU LEU PHE 0.474747 0.730769
51 ALA GLN PHE SER ALA SER ALA SER ARG 0.473684 0.704918
52 GLY GLY LYS LYS LYS TYR GLN LEU 0.473684 0.821429
53 THR ASN GLU PHE TYR PHE 0.471698 0.727273
54 ASP ASN ARG LEU GLY LEU VAL TYR GLN PHE 0.471154 0.777778
55 PRO GLU SEP LEU GLU SER CYS PHE 0.470588 0.68254
56 ASP PHE SER ILE 0.470588 0.727273
57 ALA ARG THR GLU LEU TYR ARG SER LEU 0.468254 0.790323
58 GLU LEU LYS ARG LYS MET ILE TYR MET 0.465649 0.69697
59 TYR GLY GLY PHE MET 0.464286 0.775862
60 THR ASN GLU TYR LYS VAL 0.464286 0.818182
61 SER SER LEU GLU ASN PHE ARG ALA TYR VAL 0.464286 0.822581
62 SER ILE ILE ASN PHE GLU LYS LEU 0.463415 0.807018
63 LYS SER LYS 0.45977 0.735849
64 ACE ILE TYR GLU SER LEU 0.459459 0.87037
65 PHE ARG SER LYS GLY GLU GLU LEU PHE THR 0.459259 0.774194
66 LYS ALA VAL TYR ASN PHE ALA THR MET 0.458015 0.833333
67 LEU LEU PHE GLY PHE PRO VAL TYR VAL 0.456522 0.75
68 LEU LEU PHE GLY TYR PRO VAL TYR VAL 0.456522 0.75
69 LEU ALA ILE TYR SER 0.454545 0.830189
70 SER LEU TYR ASN THR VAL ALA THR LEU 0.454545 0.803571
71 SER LEU PHE ASN THR VAL ALA THR LEU 0.454545 0.75
72 ALA ILE PHE GLN SER SER MET THR LYS 0.453125 0.754098
73 PHE TYR ARG TYR GLY PHE VAL ALA ASN PHE 0.452381 0.741935
74 PHE TYR ALA PRO GLU PRO ILE THR SER LEU 0.451389 0.764706
75 ASP ASN ARG LEU GLY LEU VAL TYR TRP PHE 0.451327 0.706897
76 SER LEU TYR ASN VAL VAL ALA THR LEU 0.45082 0.803571
77 GLY SER ASP PRO PHE LYS 0.45 0.636364
78 GLY GLY ARG LYS LYS TYR LYS LEU 0.449153 0.741935
79 GLY GLY LYS LYS ARG TYR LYS LEU 0.449153 0.741935
80 GLY GLY LYS LYS LYS TYR ARG LEU 0.449153 0.741935
81 PHE GLN TRP MET GLY TYR GLU LEU TRP 0.448276 0.712121
82 LYS ALA VAL TYR ASN LEU ALA THR MET 0.44697 0.8
83 PRO LEU SER LYS 0.446602 0.758621
84 GLY GLN VAL PRO PHE SER LYS GLU GLU CYS 0.445378 0.688525
85 GLN VAL ASN PHE LEU GLY LYS 0.443548 0.754386
86 THR PRO ASP TYR PHE LEU 0.443478 0.827586
87 SER LEU PHE ASN THR VAL ALA THR LEU TYR 0.442748 0.821429
88 GLY ALA ASP ILE PHE TYR LEU ASP GLY ALA 0.442623 0.8
89 ASP SER LYS ASP VAL LYS GLU TRP TYR VAL ZN 0.442029 0.796875
90 ACE PHE ALA TYR M3L SER NH2 0.441667 0.806452
91 LEU LEU PHE GLY LYS PRO VAL TYR VAL 0.440559 0.738462
92 ACE GLU ASN LEU TYR PHE GLN SER GLY THR 0.44 0.821429
93 THR TYR PHE ALA VAL LEU MET VAL SER 0.439394 0.857143
94 ASP ASP LEU TYR GLY 0.439252 0.8
95 SER LEU TYR ASN THR ILE ALA THR LEU 0.439024 0.807018
96 LYS HPE LYS 0.438776 0.679245
97 GLN SER TYR TPO VAL 0.438596 0.730159
98 LYS LEU PRO ALA GLN PHE TYR ILE LEU 0.4375 0.701493
99 SER LEU PHE ASN THR ILE ALA VAL LEU 0.436508 0.754386
100 ALA LEU TYR ASN THR ALA ALA ALA LEU 0.435897 0.75
101 GLU LEU ASN ARG LYS MET ILE TYR MET 0.435714 0.716418
102 PHE GLU ALA ILE PRO ALA GLU TYR LEU 0.435714 0.723077
103 ARG GLY TYR LEU TYR GLN GLY LEU 0.435484 0.770492
104 GLN PHE LYS ASP ASN VAL ILE LEU LEU 0.435115 0.754386
105 CYS THR PHE LYS THR LYS THR ASN 0.434783 0.758621
106 PHE ALA PRO GLY PHE PHE PRO TYR LEU 0.433824 0.716418
107 SER ILE ILE GLY PHE GLU LYS LEU 0.433071 0.836364
108 SER SER ARG LYS GLU TYR TYR ALA 0.431034 0.754098
109 SER GLU LEU GLU ILE LYS ARG TYR 0.430769 0.806452
110 PHE LEU PRO SER ASP PHE PHE PRO SER VAL 0.430769 0.742424
111 ASP ALA ASP GLU TYR LEU 0.429825 0.777778
112 GLU ILE ILE ASN PHE GLU LYS LEU 0.428571 0.736842
113 LEU PRO PHE GLU LYS SER THR VAL MET 0.427586 0.671429
114 MET PHE SER ILE ASP ASN ILE LEU ALA 0.427481 0.721311
115 THR ASN GLU PHE TYR ALA 0.42735 0.785714
116 SER ASP TYR GLN ARG LEU 0.42735 0.766667
117 LYS MET ASP SEP PHE LEU ASP MET GLN LEU 0.426471 0.647059
118 LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE 0.425532 0.774194
119 VAL LYS VAL VAL ALA LYS LYS TYR ARG ASN 0.425 0.758065
120 THR LYS CYS VAL PHE MET 0.425 0.807018
121 ASN ALA LEU LEU ARG TYR LEU LEU ASP 0.424779 0.714286
122 THR PHE LYS LYS THR ASN 0.424779 0.754386
123 TI2 0.424242 0.666667
124 LYS VAL ILE THR PHE ILE ASP LEU 0.424 0.818182
125 ARG LEU TRP SER 0.423729 0.692308
126 TYR MET PHE PRO ASN ALA PRO TYR LEU 0.423611 0.671233
127 GLU THR PHE TYR VAL ASP GLY 0.422764 0.872727
128 SER SER VAL VAL GLY VAL TRP TYR LEU 0.422222 0.816667
129 ASP GLU LEU GLU ILE LYS ALA TYR 0.421875 0.836364
130 ASP PHE GLU ASP TYR GLU PHE ASP 0.421053 0.759259
131 GLU LEU GLU LYS TRP ALA SER 0.420635 0.766667
132 CYS VAL PHE MET 0.420561 0.678571
133 ILE LEU ALA LYS PHE LEU HIS THR LEU 0.419118 0.770492
134 LEU GLY TYR GLY PHE VAL ASN TYR ILE 0.418605 0.824561
135 PRO ALA ILE LEU TYR ALA LEU LEU SER SER 0.418605 0.847458
136 VAL GLN GLN GLU SER SER PHE VAL MET 0.418033 0.745763
137 FME TYR PHE ILE ASN ILE LEU THR LEU 0.41791 0.770492
138 LYS SER LEU LEU GLN GLN LEU LEU THR GLU 0.417391 0.785714
139 ASP LEU TYR CYS TYR GLU GLN LEU ASN 0.416 0.842105
140 PHE SER ALA PTR VAL SER GLU GLU ASP 0.414634 0.737705
141 LYS PHE LYS 0.414141 0.622642
142 GLU LEU LYS TPO GLU ARG TYR 0.413534 0.695652
143 GLU THR LEU GLU ASP SER VAL PHE 0.413462 0.740741
144 SER ASN TRP SER HIS PRO GLN PHE GLU LYS 0.412903 0.642857
145 THR ASN GLU TYR TYR VAL 0.412844 0.781818
146 GLY ILE LEU GLU PHE VAL PHE THR LEU 0.412698 0.833333
147 CYS THR GLU LEU LYS LEU ASN ASP TYR 0.412214 0.859649
148 LEU SER SER PRO VAL THR LYS SER PHE 0.411765 0.723077
149 MET LEU TRP GLY TYR LEU GLN TYR VAL 0.411348 0.723077
150 TYR GLN GLU SER THR ASP PHE THR PHE LEU 0.410714 0.759259
151 SER LEU PHE HIS 22G THR PRO 0.410596 0.764706
152 LEU TYR ALA SER PRO GLN LEU GLU GLY PHE 0.410596 0.784615
153 GLU LEU ASP HOX TRP ALA SER 0.410448 0.714286
154 SER HIS PHE ASN GLU TYR GLU 0.410448 0.730159
155 CYS ASP PTR ALA ASN PHE LYS 0.410448 0.69697
156 LEU SER PRO ASP SER PHE LEU ASN ASP 0.41 0.769231
157 ALA GLU THR PHE TYR VAL ASP GLY 0.409836 0.833333
158 ALA TRP LEU PHE GLU ALA 0.408 0.661017
159 ALA VAL TYR ASN PHE ALA THR MET 0.407692 0.766667
160 GLU LEU ASP LYS TRP ALA SER 0.407692 0.783333
161 TYR LEU ASP SER GLY ILE HIS SER GLY ALA 0.407407 0.738462
162 ILE LEU ALA LYS PHE LEU HIS GLU LEU 0.407407 0.677419
163 ARG VAL LEU PHE GLU ALA MET 0.406015 0.630769
164 LEU PHE GLY TYR PRO VAL TYR VAL 0.405797 0.75
165 ALA THR VAL ARG THR TYR SER CYS 0.404762 0.786885
166 LYS ALA VAL PHE ASN PHE ALA THR MET 0.40458 0.783333
167 BD5 0.403846 0.690909
168 SER SER ILE GLU PHE ALA ARG LEU 0.402985 0.725806
169 SER SER VAL ILE GLY VAL TRP TYR LEU 0.401408 0.803279
170 LEU PRO PHE ASP LYS SER THR ILE MET 0.401316 0.661972
171 GLN VAL PRO LEU ARG PRO MET THR TYR LYS 0.4 0.636364
172 LYS ALN LYS 0.4 0.722222
173 ACE SER LEU ASN PHE 0.4 0.719298
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1JQ9; Ligand: PHE LEU SER TYR LYS; Similar sites found: 28
This union binding pocket(no: 1) in the query (biounit: 1jq9.bio4) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4LWU 20U 0.0001686 0.50772 None
2 3B6C SDN 0.001622 0.48087 None
3 1LNX URI 0.006987 0.44977 None
4 2V57 PRL 0.02592 0.41371 None
5 1Q8S MAN MMA 0.02842 0.41384 2.47934
6 1Q8Q MAN MMA 0.02977 0.41305 2.47934
7 1UKG MMA 0.0404 0.4047 2.47934
8 3SHZ 5CO 0.02184 0.41223 4.13223
9 2FDW D3G 0.03112 0.40806 4.13223
10 5N53 8NB 0.02601 0.41876 4.95868
11 2QES ADE 0.004997 0.45933 5.78512
12 4RW3 SHV 0.009548 0.4229 5.78512
13 3KU0 ADE 0.00301 0.47321 6.61157
14 5T46 MGP 0.03266 0.41967 6.61157
15 5BXV MGP 0.04752 0.40608 6.61157
16 2YOO K2B 0.01416 0.40427 6.61157
17 3GL0 HXX 0.02824 0.40292 6.61157
18 1YXM ADE 0.04241 0.40049 6.61157
19 2JHP GUN 0.01917 0.41677 7.43802
20 2WH8 II2 0.03607 0.40467 8.26446
21 1MRH FMC 0.01655 0.42686 9.09091
22 4OAS 2SW 0.0002946 0.49596 9.375
23 1M2Z BOG 0.0001169 0.57725 9.91736
24 1GEG GLC 0.006573 0.46306 9.91736
25 1NHZ 486 0.01092 0.40634 9.91736
26 4UCC ZKW 0.03646 0.41351 10.7438
27 5LX9 OLB 0.01747 0.40979 11.5702
28 4MNS 2AX 0.005663 0.40411 22.314
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