Receptor
PDB id Resolution Class Description Source Keywords
2PVV 2.11 Å EC: 3.4.17.21 STRUCTURE OF HUMAN GLUTAMATE CARBOXYPEPTIDASE II (GCPII) IN WITH L-SERINE-O-SULFATE HOMO SAPIENS PROSTATE SPECIFIC MEMBRANE ANTIGEN; METALLOPEPTIDASE; FOLATEHYDROLASE; GLUTAMATE CARBOXYPEPTIDASE II; NAALADASE; L-SERISULFATE; L-SOS HYDROLASE
Ref.: STRUCTURAL INSIGHT INTO THE PHARMACOPHORE POCKET OF GLUTAMATE CARBOXYPEPTIDASE II. J.MED.CHEM. V. 50 3267 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:1753;
Part of Protein;
none;
submit data
40.078 Ca [Ca+2...
CL A:1754;
Invalid;
none;
submit data
35.453 Cl [Cl-]
NAG A:1757;
A:1759;
A:1760;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
221.208 C8 H15 N O6 CC(=O...
NAG NAG C:1;
B:1;
D:1;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
408.404 n/a O=C(N...
NAG NAG MAN MAN E:1;
Invalid;
none;
submit data
n/a n/a
OSE A:1768;
Valid;
none;
ic50 = 438 uM
185.156 C3 H7 N O6 S C([C@...
ZN A:1751;
A:1752;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4X3R 1.86 Å EC: 3.4.17.21 AVI-GCPII STRUCTURE IN COMPLEX WITH FITC-CONJUGATED GCPII-SP INHIBITOR HOMO SAPIENS GLYCOPROTEIN METALLOPEPTIDASE INHIBITOR HYDROLASE
Ref.: DESIGN OF HIGHLY POTENT UREA-BASED, EXOSITE-BINDING INHIBITORS SELECTIVE FOR GLUTAMATE CARBOXYPEPTIDASE J.MED.CHEM. V. 58 4357 2015
Members (53)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3D7F ic50 = 0.5 nM YBY C15 H17 I N2 O8 c1cc(c(cc1....
2 3BI0 ic50 = 14 nM BIX C10 H18 N O8 P C(CC(=O)O)....
3 6H7Z ic50 = 0.075 nM FVW C18 H23 F N4 O8 CN(c1ccc(n....
4 6FE5 - D6E C12 H20 N2 O7 CC(C)C[C@@....
5 4OC3 Ki = 5.3 nM 2QP C21 H24 I N3 O7 c1cc(oc1)C....
6 4MCR - 29D C34 H40 N10 O15 c1cc(ccc1C....
7 2XEF Ki = 0.145 nM AR8 C37 H60 N8 O19 c1cc(c(cc1....
8 4OC2 Ki = 5.3 nM 2QQ C19 H22 I N3 O6 C#CC[C@@H]....
9 2PVV ic50 = 438 uM OSE C3 H7 N O6 S C([C@@H](C....
10 2PVW ic50 = 0.3 nM G88 C6 H11 O7 P C(CC(=O)O)....
11 4OC1 Ki = 254 nM 2QS C19 H24 I N3 O7 c1cc(ccc1C....
12 4P4D ic50 = 1800 nM 2GR C14 H19 N2 O8 P c1ccc(cc1)....
13 4MCS - ASP C4 H7 N O4 C([C@@H](C....
14 3SJE - SDR C15 H26 N2 O6 CCCCCCC[C@....
15 4X3R Ki = 0.0086 nM 686 C60 H59 Br N8 O14 c1cc(ccc1C....
16 4P4J ic50 = 700 nM 2H9 C15 H19 N2 O10 P c1ccc(cc1)....
17 3D7D ic50 = 14 nM FBD C16 H19 F N2 O7 S c1cc(ccc1C....
18 4OC5 Ki = 85 nM 2QM C22 H24 I N3 O7 c1cc(ccc1[....
19 2C6C ic50 = 30 nM 24I C13 H16 I O6 P c1cc(ccc1C....
20 4P4B ic50 = 14 nM 2G2 C13 H22 N3 O12 P C(CC(=O)N[....
21 3D7G ic50 = 17 nM MUD C10 H16 N2 O7 S CSC[C@@H](....
22 3SJF Ki = 23 nM JRG C19 H26 I N3 O6 S CSCC[C@@H]....
23 3BI1 ic50 = 0.12 nM 3BI C25 H31 N8 O9 P C[N@](Cc1c....
24 4P4I ic50 = 35 nM 2G5 C15 H19 N2 O10 P c1ccc(cc1)....
25 4P44 ic50 = 16 nM 2F7 C21 H29 F N3 O11 P CC[C@@H](C....
26 5D29 ic50 = 97 nM 5Q1 C13 H15 N O6 c1cc(ccc1C....
27 5OF0 - 9TB C19 H24 F N3 O8 c1cc(ccc1C....
28 3SJG - SDR C15 H26 N2 O6 CCCCCCC[C@....
29 5F09 - BC8 C11 H15 N O10 C(CC(=O)O)....
30 4P4F ic50 = 168 nM 2GB C18 H20 N O7 P c1ccc(cc1)....
31 4MCQ - 29C C29 H33 N9 O12 c1cc(ccc1C....
32 2XEG Ki = 0.02 nM CI9 C29 H46 N8 O15 c1cc(c(cc1....
33 2OR4 ic50 = 9.5 uM QUS C5 H7 N3 O5 C([C@@H](C....
34 2XEJ Ki = 1.34 nM OKD C24 H41 N5 O12 COCCOCCOCC....
35 4P45 ic50 = 16 nM 2F9 C20 H27 F N3 O11 P CC(C)[C@@H....
36 3D7H ic50 = 0.06 nM YC2 C19 H24 I N3 O8 c1cc(ccc1C....
37 4P4E ic50 = 180 nM 2G4 C15 H22 N O7 P c1ccc(cc1)....
38 6H7Y ic50 = 0.35 nM FVZ C18 H22 F N3 O8 c1cc(ccc1N....
39 2JBJ Ki = 0.2 nM G88 C6 H11 O7 P C(CC(=O)O)....
40 2XEI Ki = 0.024 nM ARK C25 H36 N8 O13 c1cc(c(cc1....
41 6HKJ ic50 = 0.99 nM G8W C17 H21 F N4 O8 c1cc(ncc1N....
42 3BXM - ACE ASP GLU n/a n/a
43 6S1X ic50 = 107 nM KRZ C20 H25 I N4 O9 c1cc(ccc1C....
44 3BHX ic50 = 0.7 nM BHX C9 H15 O8 P C(CC(=O)O)....
45 4OC4 Ki = 105 nM 2QN C22 H25 I N4 O6 c1cc(ccc1C....
46 5ELY ic50 = 44 nM 5PU C13 H15 N O6 c1cc(ccc1C....
47 4OC0 Ki = 318 nM 2R7 C18 H22 I N3 O6 c1cc(ccc1C....
48 4MCP - 28Z C24 H26 N8 O9 c1cc(ccc1C....
49 3SJX - QRG C11 H18 N2 O6 S CC(=O)N[C@....
50 6RBC ic50 = 3.97 nM JX5 C20 H25 I N4 O9 c1cc(ccc1C....
51 6HKZ ic50 = 0.13 nM GBZ C26 H30 F N5 O9 c1ccc(cc1)....
52 3IWW Ki = 11 nM YZE C19 H24 I N3 O6 C=CC[C@@H]....
53 3RBU Ki = 370 pM G88 C6 H11 O7 P C(CC(=O)O)....
70% Homology Family (55)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3D7F ic50 = 0.5 nM YBY C15 H17 I N2 O8 c1cc(c(cc1....
2 3BI0 ic50 = 14 nM BIX C10 H18 N O8 P C(CC(=O)O)....
3 6H7Z ic50 = 0.075 nM FVW C18 H23 F N4 O8 CN(c1ccc(n....
4 6FE5 - D6E C12 H20 N2 O7 CC(C)C[C@@....
5 4OC3 Ki = 5.3 nM 2QP C21 H24 I N3 O7 c1cc(oc1)C....
6 4MCR - 29D C34 H40 N10 O15 c1cc(ccc1C....
7 2XEF Ki = 0.145 nM AR8 C37 H60 N8 O19 c1cc(c(cc1....
8 4OC2 Ki = 5.3 nM 2QQ C19 H22 I N3 O6 C#CC[C@@H]....
9 2PVV ic50 = 438 uM OSE C3 H7 N O6 S C([C@@H](C....
10 2PVW ic50 = 0.3 nM G88 C6 H11 O7 P C(CC(=O)O)....
11 4OC1 Ki = 254 nM 2QS C19 H24 I N3 O7 c1cc(ccc1C....
12 4P4D ic50 = 1800 nM 2GR C14 H19 N2 O8 P c1ccc(cc1)....
13 4MCS - ASP C4 H7 N O4 C([C@@H](C....
14 3SJE - SDR C15 H26 N2 O6 CCCCCCC[C@....
15 4X3R Ki = 0.0086 nM 686 C60 H59 Br N8 O14 c1cc(ccc1C....
16 4P4J ic50 = 700 nM 2H9 C15 H19 N2 O10 P c1ccc(cc1)....
17 3D7D ic50 = 14 nM FBD C16 H19 F N2 O7 S c1cc(ccc1C....
18 4OC5 Ki = 85 nM 2QM C22 H24 I N3 O7 c1cc(ccc1[....
19 2C6C ic50 = 30 nM 24I C13 H16 I O6 P c1cc(ccc1C....
20 4P4B ic50 = 14 nM 2G2 C13 H22 N3 O12 P C(CC(=O)N[....
21 3D7G ic50 = 17 nM MUD C10 H16 N2 O7 S CSC[C@@H](....
22 3SJF Ki = 23 nM JRG C19 H26 I N3 O6 S CSCC[C@@H]....
23 3BI1 ic50 = 0.12 nM 3BI C25 H31 N8 O9 P C[N@](Cc1c....
24 4P4I ic50 = 35 nM 2G5 C15 H19 N2 O10 P c1ccc(cc1)....
25 4P44 ic50 = 16 nM 2F7 C21 H29 F N3 O11 P CC[C@@H](C....
26 5D29 ic50 = 97 nM 5Q1 C13 H15 N O6 c1cc(ccc1C....
27 5OF0 - 9TB C19 H24 F N3 O8 c1cc(ccc1C....
28 3SJG - SDR C15 H26 N2 O6 CCCCCCC[C@....
29 5F09 - BC8 C11 H15 N O10 C(CC(=O)O)....
30 4P4F ic50 = 168 nM 2GB C18 H20 N O7 P c1ccc(cc1)....
31 4MCQ - 29C C29 H33 N9 O12 c1cc(ccc1C....
32 2XEG Ki = 0.02 nM CI9 C29 H46 N8 O15 c1cc(c(cc1....
33 2OR4 ic50 = 9.5 uM QUS C5 H7 N3 O5 C([C@@H](C....
34 2XEJ Ki = 1.34 nM OKD C24 H41 N5 O12 COCCOCCOCC....
35 4P45 ic50 = 16 nM 2F9 C20 H27 F N3 O11 P CC(C)[C@@H....
36 3D7H ic50 = 0.06 nM YC2 C19 H24 I N3 O8 c1cc(ccc1C....
37 4P4E ic50 = 180 nM 2G4 C15 H22 N O7 P c1ccc(cc1)....
38 6H7Y ic50 = 0.35 nM FVZ C18 H22 F N3 O8 c1cc(ccc1N....
39 2JBJ Ki = 0.2 nM G88 C6 H11 O7 P C(CC(=O)O)....
40 2XEI Ki = 0.024 nM ARK C25 H36 N8 O13 c1cc(c(cc1....
41 6HKJ ic50 = 0.99 nM G8W C17 H21 F N4 O8 c1cc(ncc1N....
42 3BXM - ACE ASP GLU n/a n/a
43 6S1X ic50 = 107 nM KRZ C20 H25 I N4 O9 c1cc(ccc1C....
44 3BHX ic50 = 0.7 nM BHX C9 H15 O8 P C(CC(=O)O)....
45 4OC4 Ki = 105 nM 2QN C22 H25 I N4 O6 c1cc(ccc1C....
46 5ELY ic50 = 44 nM 5PU C13 H15 N O6 c1cc(ccc1C....
47 4OC0 Ki = 318 nM 2R7 C18 H22 I N3 O6 c1cc(ccc1C....
48 4MCP - 28Z C24 H26 N8 O9 c1cc(ccc1C....
49 3SJX - QRG C11 H18 N2 O6 S CC(=O)N[C@....
50 6RBC ic50 = 3.97 nM JX5 C20 H25 I N4 O9 c1cc(ccc1C....
51 6HKZ ic50 = 0.13 nM GBZ C26 H30 F N5 O9 c1ccc(cc1)....
52 3IWW Ki = 11 nM YZE C19 H24 I N3 O6 C=CC[C@@H]....
53 3RBU Ki = 370 pM G88 C6 H11 O7 P C(CC(=O)O)....
54 3FEE Ki = 230 nM QUS C5 H7 N3 O5 C([C@@H](C....
55 3FED Ki = 34.6 nM BIX C10 H18 N O8 P C(CC(=O)O)....
50% Homology Family (55)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3D7F ic50 = 0.5 nM YBY C15 H17 I N2 O8 c1cc(c(cc1....
2 3BI0 ic50 = 14 nM BIX C10 H18 N O8 P C(CC(=O)O)....
3 6H7Z ic50 = 0.075 nM FVW C18 H23 F N4 O8 CN(c1ccc(n....
4 6FE5 - D6E C12 H20 N2 O7 CC(C)C[C@@....
5 4OC3 Ki = 5.3 nM 2QP C21 H24 I N3 O7 c1cc(oc1)C....
6 4MCR - 29D C34 H40 N10 O15 c1cc(ccc1C....
7 2XEF Ki = 0.145 nM AR8 C37 H60 N8 O19 c1cc(c(cc1....
8 4OC2 Ki = 5.3 nM 2QQ C19 H22 I N3 O6 C#CC[C@@H]....
9 2PVV ic50 = 438 uM OSE C3 H7 N O6 S C([C@@H](C....
10 2PVW ic50 = 0.3 nM G88 C6 H11 O7 P C(CC(=O)O)....
11 4OC1 Ki = 254 nM 2QS C19 H24 I N3 O7 c1cc(ccc1C....
12 4P4D ic50 = 1800 nM 2GR C14 H19 N2 O8 P c1ccc(cc1)....
13 4MCS - ASP C4 H7 N O4 C([C@@H](C....
14 3SJE - SDR C15 H26 N2 O6 CCCCCCC[C@....
15 4X3R Ki = 0.0086 nM 686 C60 H59 Br N8 O14 c1cc(ccc1C....
16 4P4J ic50 = 700 nM 2H9 C15 H19 N2 O10 P c1ccc(cc1)....
17 3D7D ic50 = 14 nM FBD C16 H19 F N2 O7 S c1cc(ccc1C....
18 4OC5 Ki = 85 nM 2QM C22 H24 I N3 O7 c1cc(ccc1[....
19 2C6C ic50 = 30 nM 24I C13 H16 I O6 P c1cc(ccc1C....
20 4P4B ic50 = 14 nM 2G2 C13 H22 N3 O12 P C(CC(=O)N[....
21 3D7G ic50 = 17 nM MUD C10 H16 N2 O7 S CSC[C@@H](....
22 3SJF Ki = 23 nM JRG C19 H26 I N3 O6 S CSCC[C@@H]....
23 3BI1 ic50 = 0.12 nM 3BI C25 H31 N8 O9 P C[N@](Cc1c....
24 4P4I ic50 = 35 nM 2G5 C15 H19 N2 O10 P c1ccc(cc1)....
25 4P44 ic50 = 16 nM 2F7 C21 H29 F N3 O11 P CC[C@@H](C....
26 5D29 ic50 = 97 nM 5Q1 C13 H15 N O6 c1cc(ccc1C....
27 5OF0 - 9TB C19 H24 F N3 O8 c1cc(ccc1C....
28 3SJG - SDR C15 H26 N2 O6 CCCCCCC[C@....
29 5F09 - BC8 C11 H15 N O10 C(CC(=O)O)....
30 4P4F ic50 = 168 nM 2GB C18 H20 N O7 P c1ccc(cc1)....
31 4MCQ - 29C C29 H33 N9 O12 c1cc(ccc1C....
32 2XEG Ki = 0.02 nM CI9 C29 H46 N8 O15 c1cc(c(cc1....
33 2OR4 ic50 = 9.5 uM QUS C5 H7 N3 O5 C([C@@H](C....
34 2XEJ Ki = 1.34 nM OKD C24 H41 N5 O12 COCCOCCOCC....
35 4P45 ic50 = 16 nM 2F9 C20 H27 F N3 O11 P CC(C)[C@@H....
36 3D7H ic50 = 0.06 nM YC2 C19 H24 I N3 O8 c1cc(ccc1C....
37 4P4E ic50 = 180 nM 2G4 C15 H22 N O7 P c1ccc(cc1)....
38 6H7Y ic50 = 0.35 nM FVZ C18 H22 F N3 O8 c1cc(ccc1N....
39 2JBJ Ki = 0.2 nM G88 C6 H11 O7 P C(CC(=O)O)....
40 2XEI Ki = 0.024 nM ARK C25 H36 N8 O13 c1cc(c(cc1....
41 6HKJ ic50 = 0.99 nM G8W C17 H21 F N4 O8 c1cc(ncc1N....
42 3BXM - ACE ASP GLU n/a n/a
43 6S1X ic50 = 107 nM KRZ C20 H25 I N4 O9 c1cc(ccc1C....
44 3BHX ic50 = 0.7 nM BHX C9 H15 O8 P C(CC(=O)O)....
45 4OC4 Ki = 105 nM 2QN C22 H25 I N4 O6 c1cc(ccc1C....
46 5ELY ic50 = 44 nM 5PU C13 H15 N O6 c1cc(ccc1C....
47 4OC0 Ki = 318 nM 2R7 C18 H22 I N3 O6 c1cc(ccc1C....
48 4MCP - 28Z C24 H26 N8 O9 c1cc(ccc1C....
49 3SJX - QRG C11 H18 N2 O6 S CC(=O)N[C@....
50 6RBC ic50 = 3.97 nM JX5 C20 H25 I N4 O9 c1cc(ccc1C....
51 6HKZ ic50 = 0.13 nM GBZ C26 H30 F N5 O9 c1ccc(cc1)....
52 3IWW Ki = 11 nM YZE C19 H24 I N3 O6 C=CC[C@@H]....
53 3RBU Ki = 370 pM G88 C6 H11 O7 P C(CC(=O)O)....
54 3FEE Ki = 230 nM QUS C5 H7 N3 O5 C([C@@H](C....
55 3FED Ki = 34.6 nM BIX C10 H18 N O8 P C(CC(=O)O)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: OSE; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 OSE 1 1
2 OCS 0.516129 0.829787
3 SEP 0.405405 0.733333
Similar Ligands (3D)
Ligand no: 1; Ligand: OSE; Similar ligands found: 344
No: Ligand Similarity coefficient
1 3PG 0.9871
2 HG3 0.9692
3 13P 0.9683
4 AKG 0.9668
5 OGA 0.9667
6 GLU 0.9622
7 GP9 0.9605
8 GPF 0.9585
9 9ON 0.9583
10 PEP 0.9579
11 PMF 0.9553
12 B85 0.9548
13 GPJ 0.9543
14 DGL 0.9537
15 PGH 0.9530
16 2HG 0.9521
17 PSE 0.9488
18 HPV 0.9485
19 GLN 0.9470
20 PPR 0.9454
21 HIS 0.9452
22 G3H 0.9450
23 X0V 0.9445
24 CCE 0.9443
25 NM3 0.9429
26 G3P 0.9426
27 CYX 0.9425
28 AT3 0.9423
29 1SA 0.9415
30 GGL 0.9414
31 E4P 0.9412
32 ONL 0.9411
33 CCD 0.9405
34 3S5 0.9382
35 TPO 0.9371
36 S2G 0.9368
37 2PG 0.9360
38 IP8 0.9353
39 MLT 0.9340
40 2IT 0.9334
41 152 0.9334
42 HPS 0.9334
43 SYC 0.9318
44 ASP 0.9307
45 FB2 0.9294
46 GUA 0.9290
47 URQ 0.9284
48 LYS 0.9284
49 PC 0.9283
50 AL0 0.9274
51 QMP 0.9270
52 ZGL 0.9269
53 PMB 0.9266
54 1GP 0.9265
55 LUQ 0.9264
56 LFC 0.9236
57 GZ3 0.9234
58 3SL 0.9234
59 P22 0.9233
60 RAT 0.9223
61 FOM 0.9222
62 HBU 0.9222
63 CHH 0.9219
64 RTK 0.9214
65 ASN 0.9207
66 EKZ 0.9197
67 TLA 0.9196
68 PAC 0.9196
69 1SH 0.9193
70 LTL 0.9192
71 LMR 0.9192
72 ACH 0.9190
73 Q03 0.9188
74 FBW 0.9181
75 DGN 0.9171
76 OAA 0.9158
77 SPA 0.9147
78 SPV 0.9143
79 DZA 0.9141
80 MUC 0.9141
81 NLE 0.9140
82 LEU 0.9140
83 6JN 0.9135
84 ORN 0.9133
85 DHI 0.9132
86 HCI 0.9132
87 4NG 0.9122
88 HGA 0.9122
89 HHI 0.9122
90 TIH 0.9119
91 NSB 0.9114
92 SME 0.9113
93 DPN 0.9112
94 SYM 0.9108
95 FK8 0.9099
96 DIR 0.9098
97 PHE 0.9098
98 MJ2 0.9093
99 9X6 0.9092
100 PGA 0.9092
101 DYT 0.9089
102 TAR 0.9087
103 DEZ 0.9086
104 XXG 0.9085
105 0VT 0.9081
106 4LR 0.9078
107 MHO 0.9076
108 5XB 0.9076
109 GRO 0.9075
110 8EW 0.9075
111 0V5 0.9069
112 XCZ 0.9069
113 ALA ALA 0.9069
114 QY9 0.9069
115 DAL DAL 0.9065
116 DLY 0.9062
117 KPC 0.9059
118 129 0.9056
119 HMS 0.9056
120 URO 0.9056
121 3LR 0.9052
122 PPY 0.9052
123 PZI 0.9051
124 XIZ 0.9048
125 GLY GLY 0.9048
126 PEQ 0.9045
127 O45 0.9045
128 OEG 0.9045
129 MET 0.9044
130 9RW 0.9044
131 FOC 0.9043
132 F98 0.9041
133 HIO 0.9038
134 KMH 0.9037
135 C5A 0.9037
136 1X4 0.9028
137 GVM 0.9027
138 CIZ 0.9026
139 PO6 0.9026
140 DHM 0.9020
141 A13 0.9017
142 SOR 0.9011
143 8GL 0.9009
144 2FM 0.9007
145 98J 0.9006
146 MTL 0.9005
147 SMN 0.9004
148 5HY 0.9000
149 G2H 0.8995
150 OKG 0.8993
151 CXP 0.8992
152 HSO 0.8990
153 R67 0.8989
154 2FT 0.8984
155 9J3 0.8984
156 3HG 0.8983
157 K6H 0.8982
158 7C3 0.8981
159 HL5 0.8981
160 7OD 0.8980
161 XSP 0.8979
162 R2P 0.8978
163 CRN 0.8971
164 B3U 0.8970
165 LLQ 0.8969
166 OOG 0.8968
167 CFI 0.8965
168 MLE 0.8960
169 JYD 0.8959
170 SRT 0.8957
171 RNS 0.8954
172 3YP 0.8952
173 DOR 0.8948
174 7BC 0.8947
175 HFA 0.8947
176 B40 0.8947
177 MEQ 0.8942
178 VAH 0.8940
179 N4B 0.8938
180 0OC 0.8937
181 ISZ 0.8937
182 SKM 0.8935
183 AHN 0.8934
184 HDL 0.8933
185 8OZ 0.8932
186 FBU 0.8930
187 URP 0.8924
188 DXP 0.8922
189 Q07 0.8921
190 41K 0.8921
191 HIC 0.8918
192 P7Y 0.8918
193 ROR 0.8912
194 PAH 0.8912
195 NFA 0.8912
196 TEO 0.8910
197 UN1 0.8909
198 51R 0.8906
199 AG2 0.8903
200 2D8 0.8903
201 7WG 0.8901
202 DER 0.8901
203 0L1 0.8895
204 SHI 0.8892
205 NCT 0.8887
206 SVD 0.8887
207 2RH 0.8887
208 7UC 0.8887
209 DHS 0.8884
210 APG 0.8884
211 KVP 0.8883
212 G8M 0.8881
213 RP3 0.8881
214 TYR 0.8880
215 GLO 0.8875
216 DS0 0.8874
217 R9M 0.8874
218 ITN 0.8867
219 MAH 0.8866
220 COI 0.8866
221 ORO 0.8866
222 QFJ 0.8865
223 LX1 0.8865
224 173 0.8864
225 J9T 0.8854
226 PCA 0.8853
227 SD4 0.8850
228 RUJ 0.8850
229 PSJ 0.8849
230 HF2 0.8848
231 I38 0.8848
232 A09 0.8847
233 CMS 0.8847
234 ABF 0.8842
235 HSX 0.8841
236 MSE 0.8837
237 TIU 0.8836
238 XLS 0.8832
239 SOL 0.8822
240 9GB 0.8821
241 PEZ 0.8819
242 LYN 0.8818
243 XUL 0.8817
244 IXW 0.8816
245 Q9Z 0.8814
246 DAS 0.8813
247 9RH 0.8813
248 CS2 0.8808
249 A3M 0.8807
250 S2P 0.8806
251 3PO 0.8806
252 HSE 0.8805
253 5FX 0.8804
254 FUD 0.8804
255 SIN 0.8803
256 P80 0.8802
257 RMN 0.8800
258 PPV 0.8799
259 LY0 0.8799
260 49F 0.8798
261 BHH 0.8792
262 KPA 0.8791
263 MAE 0.8787
264 650 0.8785
265 SAF 0.8785
266 KDG 0.8783
267 1P3 0.8782
268 Q02 0.8777
269 K7M 0.8774
270 J0Z 0.8773
271 XYL 0.8768
272 RB5 0.8768
273 SC2 0.8767
274 MED 0.8765
275 I1E 0.8762
276 ONH 0.8761
277 4CS 0.8759
278 3AB 0.8758
279 E79 0.8756
280 LLH 0.8755
281 6M4 0.8754
282 QIC 0.8753
283 3OC 0.8752
284 2AL 0.8751
285 4TP 0.8748
286 8SZ 0.8746
287 LNO 0.8746
288 2TQ 0.8741
289 9YT 0.8740
290 449 0.8737
291 3AL 0.8737
292 NVA 0.8736
293 QDK 0.8735
294 ACA 0.8734
295 1DV 0.8728
296 11C 0.8727
297 ICF 0.8721
298 3NT 0.8721
299 TAG 0.8718
300 XBT 0.8718
301 GAB 0.8718
302 3MV 0.8717
303 NLP 0.8716
304 FF3 0.8715
305 SKG 0.8714
306 7N0 0.8713
307 3HB 0.8712
308 53C 0.8708
309 NXA 0.8706
310 EDR 0.8705
311 OVV 0.8702
312 N6C 0.8699
313 AMQ 0.8699
314 3BU 0.8693
315 REL 0.8682
316 VKC 0.8681
317 MD0 0.8671
318 FSG 0.8670
319 THE 0.8663
320 HTX 0.8661
321 DII 0.8661
322 RP5 0.8659
323 P58 0.8658
324 0A9 0.8648
325 3CR 0.8648
326 QUS 0.8646
327 M6H 0.8645
328 6NA 0.8642
329 PBA 0.8641
330 268 0.8621
331 DAB 0.8615
332 FEH 0.8610
333 MPJ 0.8605
334 ALA PRO 0.8602
335 DAV 0.8596
336 CIT 0.8593
337 PPK 0.8590
338 0CG 0.8581
339 1HS 0.8576
340 M5E 0.8573
341 3MF 0.8566
342 EYK 0.8551
343 HJH 0.8549
344 SHV 0.8527
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4X3R; Ligand: 686; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 4x3r.bio1) has 59 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 4X3R; Ligand: 686; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 4x3r.bio1) has 59 residues
No: Leader PDB Ligand Sequence Similarity
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