Receptor
PDB id Resolution Class Description Source Keywords
3WBG 2.15 Å NON-ENZYME: BINDING STRUCTURE OF THE HUMAN HEART FATTY ACID-BINDING PROTEIN IN C WITH 1-ANILINONAPHTALENE-8-SULPHONIC ACID HOMO SAPIENS BETA BARREL LIPID BINDING PROTEIN
Ref.: STRUCTURE OF THE HUMAN-HEART FATTY-ACID-BINDING PRO COMPLEX WITH THE FLUORESCENT PROBE 1-ANILINONAPHTHALENE-8-SULPHONIC ACID J.SYNCHROTRON RADIAT. V. 20 923 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
2AN B:201;
D:201;
A:201;
C:201;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
299.344 C16 H13 N O3 S c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3WBG 2.15 Å NON-ENZYME: BINDING STRUCTURE OF THE HUMAN HEART FATTY ACID-BINDING PROTEIN IN C WITH 1-ANILINONAPHTALENE-8-SULPHONIC ACID HOMO SAPIENS BETA BARREL LIPID BINDING PROTEIN
Ref.: STRUCTURE OF THE HUMAN-HEART FATTY-ACID-BINDING PRO COMPLEX WITH THE FLUORESCENT PROBE 1-ANILINONAPHTHALENE-8-SULPHONIC ACID J.SYNCHROTRON RADIAT. V. 20 923 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 552 families.
1 3WBG - 2AN C16 H13 N O3 S c1ccc(cc1)....
70% Homology Family (74)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 426 families.
1 1G74 Kd = 0.3 uM OLA C18 H34 O2 CCCCCCCCC=....
2 3FR5 ic50 = 0.069 uM I4A C22 H22 N2 O3 c1cc(cc(c1....
3 1LIE - PPI C3 H6 O2 CCC(=O)O
4 3FR4 ic50 = 0.049 uM F8A C21 H18 F3 N O2 c1ccc(c(c1....
5 2HNX - PLM C16 H32 O2 CCCCCCCCCC....
6 1ADL Kd = 4.4 uM ACD C20 H32 O2 CCCCCC=C/C....
7 5EDB Ki = 0.1 uM 5M8 C17 H12 Cl N O2 Cc1c(c(c2c....
8 1TOU ic50 = 1 uM B1V C12 H14 F3 N3 O2 S c1c(nc(nc1....
9 1LID - OLA C18 H34 O2 CCCCCCCCC=....
10 1LIF - STE C18 H36 O2 CCCCCCCCCC....
11 3JSQ - HNE C9 H16 O2 CCCCC[C@H]....
12 1TOW ic50 = 0.57 uM CRZ C16 H15 N O2 c1ccc2c(c1....
13 5EDC Ki = 0.022 uM 5M7 C21 H19 Cl N2 O2 c1ccc(cc1)....
14 5HZ8 Ki = 0.016 uM 65Z C21 H18 Cl2 N2 O2 c1ccc(cc1)....
15 3HK1 Ki = 0.67 uM B64 C14 H11 N O5 S2 COC(=O)c1c....
16 1LIC - PPI C3 H6 O2 CCC(=O)O
17 2NNQ Ki < 2 nM T4B C31 H26 N2 O3 CCc1c(c(nn....
18 3FR2 ic50 = 0.59 uM 8CA C20 H19 N O2 c1ccc(cc1)....
19 2ANS Kd = 1.2 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
20 5HZ6 Ki = 0.016 uM 65Y C22 H22 Cl N O2 CC(C)c1ccc....
21 3WBG - 2AN C16 H13 N O3 S c1ccc(cc1)....
22 1B56 - PLM C16 H32 O2 CCCCCCCCCC....
23 5D4A - 57Q C17 H15 N O2 c1ccc(cc1)....
24 6LJW - EHO C13 H11 N O2 c1ccc(cc1)....
25 6LJX Ki = 50690.3 nM EHO C13 H11 N O2 c1ccc(cc1)....
26 6LJU Kd = 60.1 nM EHU C20 H17 Cl N2 O2 CNc1ccc(c(....
27 5Y0F Ki = 0.21 uM 8JO C18 H14 F N O5 S COc1ccc(c2....
28 6LJT Kd = 34.4 nM EH6 C19 H14 Cl N O2 c1ccc(cc1)....
29 5D47 Ki = 0.1 uM L19 C26 H24 N2 O3 COc1cnccc1....
30 5Y12 Ki = 0.59 uM 8JX C16 H19 N O5 S COc1ccc(c2....
31 6LJS Kd = 110.6 nM EHR C19 H15 N O2 c1ccc(cc1)....
32 5D48 Ki = 0.03 uM L96 C28 H31 N3 O3 Cc1c(c(n[n....
33 5D45 Ki = 0.12 uM 57P C26 H23 N O2 c1ccc(cc1)....
34 6LJV Kd = 37.4 nM EHC C21 H16 Cl N O3 c1ccc(c(c1....
35 5Y0X Ki = 7.75 uM 8JR C18 H14 F N O5 S COc1ccc(c2....
36 5Y0G Ki = 0.2 uM 8JL C18 H14 F N O5 S COc1ccc(c2....
37 5Y13 Ki = 1.16 uM 8K0 C15 H16 Br N O4 S c1ccc2c(c1....
38 5URA Ki = 0.4 uM 8KS C28 H22 O4 c1ccc(cc1)....
39 1FDQ Kd = 53.4 nM HXA C22 H32 O2 CCC=C/CC=C....
40 4TKB - DAO C12 H24 O2 CCCCCCCCCC....
41 4TJZ - DKA C10 H20 O2 CCCCCCCCCC....
42 1HMT Kd = 1.64 uM STE C18 H36 O2 CCCCCCCCCC....
43 4TKJ - PLM C16 H32 O2 CCCCCCCCCC....
44 5HZ9 Ki = 0.093 uM 5M8 C17 H12 Cl N O2 Cc1c(c(c2c....
45 4WBK - STE C18 H36 O2 CCCCCCCCCC....
46 3WVM - STE C18 H36 O2 CCCCCCCCCC....
47 4TKH - MYR C14 H28 O2 CCCCCCCCCC....
48 1HMR Kd = 0.28 uM ELA C18 H34 O2 CCCCCCCCC=....
49 1HMS Kd = 0.43 uM OLA C18 H34 O2 CCCCCCCCC=....
50 2HMB - PLM C16 H32 O2 CCCCCCCCCC....
51 2Q9S - EIC C18 H32 O2 CCCCCC=C/C....
52 2QM9 Kd = 17 nM TDZ C24 H27 N O5 S Cc1c(c2c(c....
53 5BVT - PAM C16 H30 O2 CCCCCCC=C/....
54 4AZQ - G2A C23 H46 O4 CCCCCCCCCC....
55 4AZP Ki = 1.26 uM A9M C22 H45 N O2 CCCCCCCCCC....
56 5BVS - EIC C18 H32 O2 CCCCCC=C/C....
57 6EW4 - PLM C16 H32 O2 CCCCCCCCCC....
58 2WUT - PLM C16 H32 O2 CCCCCCCCCC....
59 6XU5 - PLM C16 H32 O2 CCCCCCCCCC....
60 4BVM - PLM C16 H32 O2 CCCCCCCCCC....
61 6XVQ - PLM C16 H32 O2 CCCCCCCCCC....
62 6XVY - PLM C16 H32 O2 CCCCCCCCCC....
63 6EW2 - PLM C16 H32 O2 CCCCCCCCCC....
64 4D6B - PLM C16 H32 O2 CCCCCCCCCC....
65 6XVR - PLM C16 H32 O2 CCCCCCCCCC....
66 6EW5 - PLM C16 H32 O2 CCCCCCCCCC....
67 6XUA - PLM C16 H32 O2 CCCCCCCCCC....
68 5N4Q - PLM C16 H32 O2 CCCCCCCCCC....
69 6S2M - PLM C16 H32 O2 CCCCCCCCCC....
70 4D6A - PLM C16 H32 O2 CCCCCCCCCC....
71 5N4P - PLM C16 H32 O2 CCCCCCCCCC....
72 6S2S - PLM C16 H32 O2 CCCCCCCCCC....
73 5N4M - PLM C16 H32 O2 CCCCCCCCCC....
74 6XUW - PLM C16 H32 O2 CCCCCCCCCC....
50% Homology Family (133)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 322 families.
1 1G74 Kd = 0.3 uM OLA C18 H34 O2 CCCCCCCCC=....
2 3FR5 ic50 = 0.069 uM I4A C22 H22 N2 O3 c1cc(cc(c1....
3 1LIE - PPI C3 H6 O2 CCC(=O)O
4 3FR4 ic50 = 0.049 uM F8A C21 H18 F3 N O2 c1ccc(c(c1....
5 2HNX - PLM C16 H32 O2 CCCCCCCCCC....
6 1ADL Kd = 4.4 uM ACD C20 H32 O2 CCCCCC=C/C....
7 5EDB Ki = 0.1 uM 5M8 C17 H12 Cl N O2 Cc1c(c(c2c....
8 1TOU ic50 = 1 uM B1V C12 H14 F3 N3 O2 S c1c(nc(nc1....
9 1LID - OLA C18 H34 O2 CCCCCCCCC=....
10 1LIF - STE C18 H36 O2 CCCCCCCCCC....
11 3JSQ - HNE C9 H16 O2 CCCCC[C@H]....
12 1TOW ic50 = 0.57 uM CRZ C16 H15 N O2 c1ccc2c(c1....
13 5EDC Ki = 0.022 uM 5M7 C21 H19 Cl N2 O2 c1ccc(cc1)....
14 5HZ8 Ki = 0.016 uM 65Z C21 H18 Cl2 N2 O2 c1ccc(cc1)....
15 3HK1 Ki = 0.67 uM B64 C14 H11 N O5 S2 COC(=O)c1c....
16 1LIC - PPI C3 H6 O2 CCC(=O)O
17 2NNQ Ki < 2 nM T4B C31 H26 N2 O3 CCc1c(c(nn....
18 3FR2 ic50 = 0.59 uM 8CA C20 H19 N O2 c1ccc(cc1)....
19 2ANS Kd = 1.2 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
20 5HZ6 Ki = 0.016 uM 65Y C22 H22 Cl N O2 CC(C)c1ccc....
21 5L8O - CHD C24 H40 O5 C[C@H](CCC....
22 5L8N Kd = 31 uM 6RQ C9 H11 N3 Cc1cc2c(cc....
23 3WBG - 2AN C16 H13 N O3 S c1ccc(cc1)....
24 5HZ5 Ki = 0.086 uM 65X C21 H19 Cl N6 c1ccc(cc1)....
25 5UR9 Ki = 0.9 uM 8KS C28 H22 O4 c1ccc(cc1)....
26 1B56 - PLM C16 H32 O2 CCCCCCCCCC....
27 5D4A - 57Q C17 H15 N O2 c1ccc(cc1)....
28 6LJW - EHO C13 H11 N O2 c1ccc(cc1)....
29 6LJX Ki = 50690.3 nM EHO C13 H11 N O2 c1ccc(cc1)....
30 6LJU Kd = 60.1 nM EHU C20 H17 Cl N2 O2 CNc1ccc(c(....
31 5Y0F Ki = 0.21 uM 8JO C18 H14 F N O5 S COc1ccc(c2....
32 6LJT Kd = 34.4 nM EH6 C19 H14 Cl N O2 c1ccc(cc1)....
33 5D47 Ki = 0.1 uM L19 C26 H24 N2 O3 COc1cnccc1....
34 5Y12 Ki = 0.59 uM 8JX C16 H19 N O5 S COc1ccc(c2....
35 6LJS Kd = 110.6 nM EHR C19 H15 N O2 c1ccc(cc1)....
36 5D48 Ki = 0.03 uM L96 C28 H31 N3 O3 Cc1c(c(n[n....
37 5D45 Ki = 0.12 uM 57P C26 H23 N O2 c1ccc(cc1)....
38 6LJV Kd = 37.4 nM EHC C21 H16 Cl N O3 c1ccc(c(c1....
39 5Y0X Ki = 7.75 uM 8JR C18 H14 F N O5 S COc1ccc(c2....
40 5Y0G Ki = 0.2 uM 8JL C18 H14 F N O5 S COc1ccc(c2....
41 5Y13 Ki = 1.16 uM 8K0 C15 H16 Br N O4 S c1ccc2c(c1....
42 5URA Ki = 0.4 uM 8KS C28 H22 O4 c1ccc(cc1)....
43 1FDQ Kd = 53.4 nM HXA C22 H32 O2 CCC=C/CC=C....
44 2G78 - REA C20 H28 O2 CC1=C(C(CC....
45 2CBS ic50 = 6 nM R13 C23 H30 O2 CC(=C/C(=O....
46 1CBS - REA C20 H28 O2 CC1=C(C(CC....
47 2FR3 Kd = 2 nM REA C20 H28 O2 CC1=C(C(CC....
48 3CWK Kd = 250 nM REA C20 H28 O2 CC1=C(C(CC....
49 3CBS ic50 = 58 nM R12 C20 H24 O3 Cc1cc(c(c(....
50 2G79 Kd = 120 nM RET C20 H28 O CC1=C(C(CC....
51 2G7B - AZE C20 H30 CC=C(/C)C=....
52 6MOR - RET C20 H28 O CC1=C(C(CC....
53 1CBQ - RE9 C20 H28 O2 CC(=C/C(=O....
54 4TKB - DAO C12 H24 O2 CCCCCCCCCC....
55 4TJZ - DKA C10 H20 O2 CCCCCCCCCC....
56 1HMT Kd = 1.64 uM STE C18 H36 O2 CCCCCCCCCC....
57 4TKJ - PLM C16 H32 O2 CCCCCCCCCC....
58 5HZ9 Ki = 0.093 uM 5M8 C17 H12 Cl N O2 Cc1c(c(c2c....
59 4WBK - STE C18 H36 O2 CCCCCCCCCC....
60 3WVM - STE C18 H36 O2 CCCCCCCCCC....
61 4TKH - MYR C14 H28 O2 CCCCCCCCCC....
62 1HMR Kd = 0.28 uM ELA C18 H34 O2 CCCCCCCCC=....
63 1HMS Kd = 0.43 uM OLA C18 H34 O2 CCCCCCCCC=....
64 2HMB - PLM C16 H32 O2 CCCCCCCCCC....
65 3VG3 - PLM C16 H32 O2 CCCCCCCCCC....
66 3B2H - PLM C16 H32 O2 CCCCCCCCCC....
67 3B2K - PLM C16 H32 O2 CCCCCCCCCC....
68 3VG6 - PLM C16 H32 O2 CCCCCCCCCC....
69 3VG5 - PLM C16 H32 O2 CCCCCCCCCC....
70 3VG7 - PLM C16 H32 O2 CCCCCCCCCC....
71 3STM - PLM C16 H32 O2 CCCCCCCCCC....
72 3VG2 - PLM C16 H32 O2 CCCCCCCCCC....
73 3B2I - PLM C16 H32 O2 CCCCCCCCCC....
74 3B2L - PLM C16 H32 O2 CCCCCCCCCC....
75 3B2J - PLM C16 H32 O2 CCCCCCCCCC....
76 3VG4 - PLM C16 H32 O2 CCCCCCCCCC....
77 6E6K - HVD C21 H30 O2 CCCCCc1cc(....
78 1OPB Kd = 50 nM RET C20 H28 O CC1=C(C(CC....
79 6E5W - HVD C21 H30 O2 CCCCCc1cc(....
80 2Q9S - EIC C18 H32 O2 CCCCCC=C/C....
81 2QM9 Kd = 17 nM TDZ C24 H27 N O5 S Cc1c(c2c(c....
82 2QO4 - CHD C24 H40 O5 C[C@H](CCC....
83 2QO6 - CHD C24 H40 O5 C[C@H](CCC....
84 2QO5 - CHD C24 H40 O5 C[C@H](CCC....
85 1TW4 - CHD C24 H40 O5 C[C@H](CCC....
86 5BVT - PAM C16 H30 O2 CCCCCCC=C/....
87 3ELZ - CHD C24 H40 O5 C[C@H](CCC....
88 3EM0 - CHD C24 H40 O5 C[C@H](CCC....
89 4AZQ - G2A C23 H46 O4 CCCCCCCCCC....
90 4AZP Ki = 1.26 uM A9M C22 H45 N O2 CCCCCCCCCC....
91 5LJG - PLM C16 H32 O2 CCCCCCCCCC....
92 6E6M Ki = 1662 nM 8CB C17 H22 O2 Cc1cc(c(c(....
93 6E5L Ki = 76.3 nM HVD C21 H30 O2 CCCCCc1cc(....
94 5LJC Kd = 65 nM RTL C20 H30 O CC1=C(C(CC....
95 5HBS Kd = 18.5 nM RTL C20 H30 O CC1=C(C(CC....
96 6E5T Ki = 236.3 nM HVJ C17 H22 O2 Cc1cc(cc(c....
97 5H8T Kd = 18.5 nM RTL C20 H30 O CC1=C(C(CC....
98 5LJE Kd = 250 nM RTL C20 H30 O CC1=C(C(CC....
99 5LJD Kd = 70 nM RTL C20 H30 O CC1=C(C(CC....
100 5LJB Kd = 4.5 nM RTL C20 H30 O CC1=C(C(CC....
101 1CRB - RTL C20 H30 O CC1=C(C(CC....
102 5HA1 Kd = 64.1 nM RNE C20 H31 N CC1=C(C(CC....
103 4QZU Kd = 2 nM RTL C20 H30 O CC1=C(C(CC....
104 4QYN Kd = 2 nM RTL C20 H30 O CC1=C(C(CC....
105 2RCT - RTL C20 H30 O CC1=C(C(CC....
106 4QZT Kd = 2 nM RTL C20 H30 O CC1=C(C(CC....
107 1VYF Kd = 9 nM OLA C18 H34 O2 CCCCCCCCC=....
108 1VYG Kd = 10 nM ACD C20 H32 O2 CCCCCC=C/C....
109 2FT9 - CHD C24 H40 O5 C[C@H](CCC....
110 2FTB - OLA C18 H34 O2 CCCCCCCCC=....
111 1ICM - MYR C14 H28 O2 CCCCCCCCCC....
112 1ICN - OLA C18 H34 O2 CCCCCCCCC=....
113 2IFB Ki = 3.6 uM PLM C16 H32 O2 CCCCCCCCCC....
114 5BVS - EIC C18 H32 O2 CCCCCC=C/C....
115 6EW4 - PLM C16 H32 O2 CCCCCCCCCC....
116 2WUT - PLM C16 H32 O2 CCCCCCCCCC....
117 6XU5 - PLM C16 H32 O2 CCCCCCCCCC....
118 4BVM - PLM C16 H32 O2 CCCCCCCCCC....
119 6XVQ - PLM C16 H32 O2 CCCCCCCCCC....
120 6XVY - PLM C16 H32 O2 CCCCCCCCCC....
121 6EW2 - PLM C16 H32 O2 CCCCCCCCCC....
122 4D6B - PLM C16 H32 O2 CCCCCCCCCC....
123 6XVR - PLM C16 H32 O2 CCCCCCCCCC....
124 6EW5 - PLM C16 H32 O2 CCCCCCCCCC....
125 6XUA - PLM C16 H32 O2 CCCCCCCCCC....
126 5N4Q - PLM C16 H32 O2 CCCCCCCCCC....
127 6S2M - PLM C16 H32 O2 CCCCCCCCCC....
128 4D6A - PLM C16 H32 O2 CCCCCCCCCC....
129 5N4P - PLM C16 H32 O2 CCCCCCCCCC....
130 6S2S - PLM C16 H32 O2 CCCCCCCCCC....
131 5N4M - PLM C16 H32 O2 CCCCCCCCCC....
132 6XUW - PLM C16 H32 O2 CCCCCCCCCC....
133 1KQW - RTL C20 H30 O CC1=C(C(CC....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 2AN; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 2AN 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 2AN; Similar ligands found: 302
No: Ligand Similarity coefficient
1 NYJ 0.9350
2 8SK 0.9331
3 5NN 0.9315
4 3GX 0.9239
5 96U 0.9212
6 E2Q 0.9207
7 CU5 0.9203
8 MFR 0.9200
9 M3W 0.9153
10 3WN 0.9132
11 3WO 0.9132
12 1EL 0.9120
13 FYJ 0.9111
14 UXH 0.9102
15 3WK 0.9088
16 DY5 0.9064
17 W8L 0.9057
18 BJ4 0.9050
19 VT3 0.9050
20 VAR 0.9049
21 34L 0.9047
22 8CA 0.9044
23 3WJ 0.9043
24 TXQ 0.9040
25 E9L 0.9033
26 SGW 0.9027
27 IDD 0.9023
28 H2W 0.9021
29 5V7 0.9014
30 5DN 0.9012
31 CDJ 0.9011
32 9TF 0.9007
33 MHR 0.9002
34 96R 0.9001
35 YJX 0.9000
36 3WL 0.8998
37 M3F 0.8990
38 YEX 0.8988
39 GI1 0.8985
40 C93 0.8983
41 3JN 0.8978
42 3JL 0.8978
43 CHQ 0.8978
44 9OF 0.8978
45 DBQ 0.8978
46 DX2 0.8976
47 B2L 0.8960
48 CGW 0.8953
49 KOM 0.8953
50 UX0 0.8951
51 PVK 0.8951
52 57D 0.8943
53 537 0.8943
54 PVQ 0.8941
55 EPK 0.8938
56 ER7 0.8935
57 5BN 0.8930
58 PK3 0.8929
59 TQ3 0.8920
60 11G 0.8920
61 GI3 0.8919
62 7M2 0.8914
63 X8E 0.8908
64 BIE 0.8907
65 PD6 0.8905
66 465 0.8904
67 RHN 0.8902
68 AFT 0.8902
69 2NJ 0.8901
70 CPW 0.8900
71 KN1 0.8899
72 HNA 0.8892
73 Q0K 0.8888
74 1V4 0.8883
75 KWG 0.8883
76 1V3 0.8879
77 OA4 0.8879
78 AP6 0.8878
79 5O4 0.8874
80 REF 0.8872
81 BHF 0.8872
82 XP0 0.8868
83 CG8 0.8865
84 L3L 0.8865
85 JVE 0.8863
86 UQ1 0.8862
87 ZSP 0.8856
88 2MQ 0.8855
89 X0T 0.8853
90 9E3 0.8850
91 1Q4 0.8849
92 KZ9 0.8844
93 DXK 0.8843
94 B52 0.8840
95 H52 0.8839
96 IQZ 0.8838
97 E1K 0.8835
98 2LX 0.8831
99 F40 0.8826
100 YK9 0.8823
101 7L4 0.8821
102 DYZ 0.8821
103 2GQ 0.8820
104 4WF 0.8817
105 OPA 0.8816
106 AN1 0.8815
107 7Z9 0.8811
108 ZJB 0.8810
109 LY2 0.8808
110 2N0 0.8808
111 7NU 0.8805
112 Q9P 0.8804
113 UI2 0.8802
114 KMP 0.8801
115 32V 0.8801
116 9Y5 0.8801
117 T02 0.8799
118 3JC 0.8799
119 P4L 0.8795
120 0Q2 0.8794
121 DY9 0.8792
122 56N 0.8790
123 JJ3 0.8788
124 GHT 0.8788
125 C8Z 0.8787
126 4KR 0.8785
127 OTA 0.8784
128 HMD 0.8783
129 9CE 0.8782
130 F5C 0.8781
131 MW5 0.8780
132 JAK 0.8778
133 7A9 0.8778
134 COL 0.8777
135 IBC 0.8777
136 7KB 0.8775
137 B2E 0.8774
138 GEN 0.8773
139 8HG 0.8772
140 3UG 0.8767
141 EMO 0.8766
142 QUE 0.8763
143 A73 0.8763
144 3KC 0.8759
145 U19 0.8758
146 7M5 0.8758
147 TQ1 0.8757
148 3AK 0.8756
149 TGW 0.8756
150 B2X 0.8755
151 B61 0.8754
152 AQN 0.8750
153 L5S 0.8749
154 1V1 0.8746
155 BC3 0.8745
156 JSN 0.8742
157 M4B 0.8742
158 340 0.8741
159 6DQ 0.8738
160 IMK 0.8737
161 25F 0.8736
162 EVO 0.8736
163 6BK 0.8734
164 P9I 0.8733
165 NPL 0.8731
166 3N4 0.8731
167 9Y8 0.8728
168 19E 0.8725
169 ALH 0.8723
170 H4B 0.8723
171 20D 0.8722
172 NRA 0.8722
173 BA5 0.8722
174 8P6 0.8717
175 S0I 0.8713
176 5WW 0.8711
177 5XL 0.8709
178 2T4 0.8708
179 22L 0.8707
180 64F 0.8706
181 NKI 0.8704
182 PZB 0.8704
183 1YL 0.8703
184 DFL 0.8702
185 RGK 0.8702
186 DX7 0.8699
187 RDL 0.8697
188 AGI 0.8694
189 6CD 0.8692
190 CZ0 0.8689
191 VGF 0.8688
192 ABJ 0.8686
193 FVV 0.8685
194 1GR 0.8681
195 5E2 0.8680
196 4E2 0.8679
197 A4V 0.8679
198 5WT 0.8678
199 CC6 0.8678
200 2QU 0.8678
201 JUO 0.8677
202 Y70 0.8670
203 NOM 0.8670
204 DLZ 0.8668
205 CX6 0.8668
206 O9Q 0.8667
207 JRO 0.8667
208 PQQ 0.8667
209 5E1 0.8665
210 9KQ 0.8664
211 3F4 0.8659
212 4E3 0.8658
213 GAT 0.8657
214 M77 0.8656
215 VUP 0.8656
216 BIO 0.8656
217 AJD 0.8656
218 UAY 0.8655
219 LU2 0.8654
220 SQM 0.8654
221 SZ5 0.8654
222 LFN 0.8654
223 36I 0.8654
224 IZA 0.8653
225 2QV 0.8653
226 AO6 0.8653
227 372 0.8650
228 AXX 0.8649
229 ST1 0.8644
230 3RQ 0.8642
231 IFM BGC 0.8640
232 T28 0.8640
233 B1V 0.8639
234 WLH 0.8636
235 1DR 0.8634
236 PIQ 0.8633
237 KY3 0.8632
238 Z21 0.8629
239 8DA 0.8628
240 C9B 0.8628
241 MQ1 0.8627
242 O9Z 0.8627
243 FNA 0.8625
244 74Z 0.8625
245 IBM 0.8625
246 29Q 0.8623
247 BRY 0.8622
248 EI1 0.8622
249 QNM 0.8621
250 CP6 0.8620
251 NAR 0.8618
252 GI4 0.8613
253 IXM 0.8612
254 AHQ 0.8612
255 3Y7 0.8610
256 AV6 0.8609
257 QZ8 0.8608
258 X04 0.8605
259 LP8 0.8605
260 SY9 0.8603
261 IQW 0.8601
262 5P3 0.8601
263 1QV 0.8601
264 5E4 0.8601
265 4KL 0.8598
266 HFT 0.8593
267 EQU 0.8592
268 8MO 0.8592
269 1D1 0.8590
270 NPZ 0.8585
271 64E 0.8585
272 1U7 0.8584
273 39Z 0.8583
274 3RR 0.8583
275 GWD 0.8582
276 XTS 0.8579
277 8HH 0.8576
278 62V 0.8575
279 1YE 0.8572
280 PLP 0.8572
281 E3U 0.8571
282 AB3 0.8569
283 A3Q 0.8569
284 K68 0.8569
285 E6Q 0.8567
286 ONZ 0.8566
287 2SK 0.8564
288 FC3 0.8563
289 K25 0.8562
290 KP2 0.8559
291 A0O 0.8558
292 3FE 0.8556
293 774 0.8552
294 MZC 0.8551
295 M9N 0.8551
296 5AD 0.8540
297 AZN 0.8540
298 54X 0.8540
299 EST 0.8537
300 HBI 0.8536
301 T6Z 0.8536
302 A1Y 0.8536
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3WBG; Ligand: 2AN; 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: 3wbg.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3WBG; Ligand: 2AN; 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: 3wbg.bio3) has 19 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3WBG; Ligand: 2AN; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3wbg.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3WBG; Ligand: 2AN; Similar sites found with APoc: 1
This union binding pocket(no: 4) in the query (biounit: 3wbg.bio4) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 5XNA SHV 31.8841
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