Receptor
PDB id Resolution Class Description Source Keywords
3DX2 1.4 Å EC: 3.2.1.114 GOLGI MANNOSIDASE II COMPLEX WITH MANNOSTATIN B DROSOPHILA MELANOGASTER GH38 GLYCOSIDASE GLYCOSIDASE GOLGI APPARATUS HYDROLASE MMETAL-BINDING SIGNAL-ANCHOR TRANSMEMBRANE ZINC
Ref.: THE MOLECULAR BASIS OF INHIBITION OF GOLGI ALPHA-MA II BY MANNOSTATIN A. CHEMBIOCHEM V. 10 268 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MPD A:1049;
A:1050;
 Invalid;
Invalid;
 none;
none;
 submit data
118.174 C6 H14 O2 C[C@@...
MRD A:1047;
 Invalid;
 none;
 submit data
118.174 C6 H14 O2 C[C@H...
MZB A:1048;
 Valid;
 none;
 Ki = 150 nM
195.237 C6 H13 N O4 S C[S@@...
ZN A:1046;
 Part of Protein;
 none;
 submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3EJR 1.27 Å EC: 3.2.1.114 GOLGI ALPHA-MANNOSIDASE II IN COMPLEX WITH 5-SUBSTITUED SWAI ANALOG: (5R)-5-[2'-OXO-2'-(4-TERT-BUTYLPHENYL)ETHYL]-SWAINS DROSOPHILA MELANOGASTER GH38 GLYCOSIDASE GLYCOSIDASE GOLGI APPARATUS HYDROLASE MMETAL-BINDING SIGNAL-ANCHOR TRANSMEMBRANE
Ref.: STRUCTURAL INVESTIGATION OF THE BINDING OF 5-SUBSTI SWAINSONINE ANALOGUES TO GOLGI ALPHA-MANNOSIDASE II CHEMBIOCHEM V. 11 673 2010
Members (46)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2OW7 ic50 = 14 uM NK2 C8 H15 O2 S C1CC[S@@+]....
2 3D51 Ki = 70 uM GOX C6 H12 N2 O5 C([C@@H]1[....
3 3CV5 - BMA MAN MAN MAN MAN n/a n/a
4 3EJS ic50 = 250 nM HN5 C20 H31 N O3 CC(C)(C)c1....
5 3DX0 Ki = 36 nM MSN C6 H13 N O3 S CS[C@@H]1[....
6 2FYV ic50 = 0.3 mM W72 C11 H21 N O9 C1[C@H]([C....
7 3BVW - YZ0 MAN Z4Y NAG MAN n/a n/a
8 3D4Z Ki = 13 uM GIM C8 H13 N2 O4 c1c[n+]2c(....
9 1TQU ic50 ~ 7.5 mM GHA C9 H18 N O9 S C1C([C@@H]....
10 3DDG Ki = 1 uM GB7 C14 H20 N2 O4 CN1[C@@H](....
11 1PS3 Ki = 5.2 mM KIF C8 H12 N2 O6 C([C@@H]1[....
12 3DX2 Ki = 150 nM MZB C6 H13 N O4 S C[S@@](=O)....
13 2F7O Ki = 0.036 uM MSN C6 H13 N O3 S CS[C@@H]1[....
14 3D52 Ki = 520 uM GHR C13 H16 Cl N3 O6 c1cc(ccc1N....
15 1TQV ic50 ~ 7.5 mM SSE C9 H18 O9 S Se C1[C@H]([C....
16 3EJU ic50 = 250 nM HN7 C20 H29 N O4 CC(C)(C)c1....
17 1HXK ic50 = 400 uM DMJ C6 H13 N O4 C1[C@H]([C....
18 1TQS - SSO C9 H18 O9 S2 C1[C@H]([C....
19 3CZN - NDG BMA MAN MAN NAG MAN MAN n/a n/a
20 2OW6 ic50 = 2 mM NK1 C8 H15 O3 S C1C[C@@H](....
21 3BUP - MAN C6 H12 O6 C([C@@H]1[....
22 3EJT ic50 = 44 nM HN6 C20 H31 N O3 CC(C)(C)c1....
23 3CZS - MAN C6 H12 O6 C([C@@H]1[....
24 3DX1 Ki = 265 uM YHO C5 H11 N O3 C1[C@H]([C....
25 2F7P Ki = 0.249 uM 2SK C13 H19 N O3 S CS[C@@H]1[....
26 3EJP Ki = 2.8 nM HN2 C16 H21 N O4 c1ccc(cc1)....
27 3BVV - YZ0 MAN Z4Y n/a n/a
28 2F18 ic50 = 80 uM GB1 C13 H20 N2 O3 c1ccc(cc1)....
29 3DX4 Ki = 76 nM GOO C6 H13 N O4 CO[C@@H]1[....
30 2F1A ic50 = 720 uM GB2 C13 H20 N2 O3 c1ccc(cc1)....
31 3D4Y Ki = 2 uM MVL C8 H12 N2 O4 c1cn2c(n1)....
32 3DDF Ki = 67 uM GB6 C13 H18 N2 O4 c1ccc(cc1)....
33 1TQT ic50 ~ 7.5 mM SSD C9 H18 O9 S2 C1[C@H]([C....
34 3DX3 Ki = 300 nM YTB C5 H11 N O4 C1([C@H]([....
35 3BUQ - MAN C6 H12 O6 C([C@@H]1[....
36 3EJR Ki = 2.7 nM HN4 C20 H29 N O4 CC(C)(C)c1....
37 1R34 ic50 = 0.9 mM LKS C14 H20 N2 O4 S [H]/N=C(/C....
38 3BVX - YZ0 MAN MAN NAG MAN n/a n/a
39 1HWW ic50 = 20 nM SWA C8 H15 N O3 C1C[C@H]([....
40 3EJQ Ki = 2.7 nM HN3 C17 H23 N O4 Cc1ccc(cc1....
41 3D50 Ki = 17 uM OEV C15 H29 N O4 CCCCCCCCN[....
42 2F1B ic50 = 1000 uM GB3 C14 H22 N2 O3 C[C@@H]1[C....
43 1R33 ic50 = 0.07 mM LKA C6 H13 N O4 S C([C@@H]1[....
44 1TQW ic50 ~ 7.5 mM BLT C9 H18 O9 S Se C1[C@H]([C....
45 3BVT - Z4R MAN n/a n/a
46 3BVU - Z4R MAN MAN n/a n/a
70% Homology Family (46)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2OW7 ic50 = 14 uM NK2 C8 H15 O2 S C1CC[S@@+]....
2 3D51 Ki = 70 uM GOX C6 H12 N2 O5 C([C@@H]1[....
3 3CV5 - BMA MAN MAN MAN MAN n/a n/a
4 3EJS ic50 = 250 nM HN5 C20 H31 N O3 CC(C)(C)c1....
5 3DX0 Ki = 36 nM MSN C6 H13 N O3 S CS[C@@H]1[....
6 2FYV ic50 = 0.3 mM W72 C11 H21 N O9 C1[C@H]([C....
7 3BVW - YZ0 MAN Z4Y NAG MAN n/a n/a
8 3D4Z Ki = 13 uM GIM C8 H13 N2 O4 c1c[n+]2c(....
9 1TQU ic50 ~ 7.5 mM GHA C9 H18 N O9 S C1C([C@@H]....
10 3DDG Ki = 1 uM GB7 C14 H20 N2 O4 CN1[C@@H](....
11 1PS3 Ki = 5.2 mM KIF C8 H12 N2 O6 C([C@@H]1[....
12 3DX2 Ki = 150 nM MZB C6 H13 N O4 S C[S@@](=O)....
13 2F7O Ki = 0.036 uM MSN C6 H13 N O3 S CS[C@@H]1[....
14 3D52 Ki = 520 uM GHR C13 H16 Cl N3 O6 c1cc(ccc1N....
15 1TQV ic50 ~ 7.5 mM SSE C9 H18 O9 S Se C1[C@H]([C....
16 3EJU ic50 = 250 nM HN7 C20 H29 N O4 CC(C)(C)c1....
17 1HXK ic50 = 400 uM DMJ C6 H13 N O4 C1[C@H]([C....
18 1TQS - SSO C9 H18 O9 S2 C1[C@H]([C....
19 3CZN - NDG BMA MAN MAN NAG MAN MAN n/a n/a
20 2OW6 ic50 = 2 mM NK1 C8 H15 O3 S C1C[C@@H](....
21 3BUP - MAN C6 H12 O6 C([C@@H]1[....
22 3EJT ic50 = 44 nM HN6 C20 H31 N O3 CC(C)(C)c1....
23 3CZS - MAN C6 H12 O6 C([C@@H]1[....
24 3DX1 Ki = 265 uM YHO C5 H11 N O3 C1[C@H]([C....
25 2F7P Ki = 0.249 uM 2SK C13 H19 N O3 S CS[C@@H]1[....
26 3EJP Ki = 2.8 nM HN2 C16 H21 N O4 c1ccc(cc1)....
27 3BVV - YZ0 MAN Z4Y n/a n/a
28 2F18 ic50 = 80 uM GB1 C13 H20 N2 O3 c1ccc(cc1)....
29 3DX4 Ki = 76 nM GOO C6 H13 N O4 CO[C@@H]1[....
30 2F1A ic50 = 720 uM GB2 C13 H20 N2 O3 c1ccc(cc1)....
31 3D4Y Ki = 2 uM MVL C8 H12 N2 O4 c1cn2c(n1)....
32 3DDF Ki = 67 uM GB6 C13 H18 N2 O4 c1ccc(cc1)....
33 1TQT ic50 ~ 7.5 mM SSD C9 H18 O9 S2 C1[C@H]([C....
34 3DX3 Ki = 300 nM YTB C5 H11 N O4 C1([C@H]([....
35 3BUQ - MAN C6 H12 O6 C([C@@H]1[....
36 3EJR Ki = 2.7 nM HN4 C20 H29 N O4 CC(C)(C)c1....
37 1R34 ic50 = 0.9 mM LKS C14 H20 N2 O4 S [H]/N=C(/C....
38 3BVX - YZ0 MAN MAN NAG MAN n/a n/a
39 1HWW ic50 = 20 nM SWA C8 H15 N O3 C1C[C@H]([....
40 3EJQ Ki = 2.7 nM HN3 C17 H23 N O4 Cc1ccc(cc1....
41 3D50 Ki = 17 uM OEV C15 H29 N O4 CCCCCCCCN[....
42 2F1B ic50 = 1000 uM GB3 C14 H22 N2 O3 C[C@@H]1[C....
43 1R33 ic50 = 0.07 mM LKA C6 H13 N O4 S C([C@@H]1[....
44 1TQW ic50 ~ 7.5 mM BLT C9 H18 O9 S Se C1[C@H]([C....
45 3BVT - Z4R MAN n/a n/a
46 3BVU - Z4R MAN MAN n/a n/a
50% Homology Family (46)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2OW7 ic50 = 14 uM NK2 C8 H15 O2 S C1CC[S@@+]....
2 3D51 Ki = 70 uM GOX C6 H12 N2 O5 C([C@@H]1[....
3 3CV5 - BMA MAN MAN MAN MAN n/a n/a
4 3EJS ic50 = 250 nM HN5 C20 H31 N O3 CC(C)(C)c1....
5 3DX0 Ki = 36 nM MSN C6 H13 N O3 S CS[C@@H]1[....
6 2FYV ic50 = 0.3 mM W72 C11 H21 N O9 C1[C@H]([C....
7 3BVW - YZ0 MAN Z4Y NAG MAN n/a n/a
8 3D4Z Ki = 13 uM GIM C8 H13 N2 O4 c1c[n+]2c(....
9 1TQU ic50 ~ 7.5 mM GHA C9 H18 N O9 S C1C([C@@H]....
10 3DDG Ki = 1 uM GB7 C14 H20 N2 O4 CN1[C@@H](....
11 1PS3 Ki = 5.2 mM KIF C8 H12 N2 O6 C([C@@H]1[....
12 3DX2 Ki = 150 nM MZB C6 H13 N O4 S C[S@@](=O)....
13 2F7O Ki = 0.036 uM MSN C6 H13 N O3 S CS[C@@H]1[....
14 3D52 Ki = 520 uM GHR C13 H16 Cl N3 O6 c1cc(ccc1N....
15 1TQV ic50 ~ 7.5 mM SSE C9 H18 O9 S Se C1[C@H]([C....
16 3EJU ic50 = 250 nM HN7 C20 H29 N O4 CC(C)(C)c1....
17 1HXK ic50 = 400 uM DMJ C6 H13 N O4 C1[C@H]([C....
18 1TQS - SSO C9 H18 O9 S2 C1[C@H]([C....
19 3CZN - NDG BMA MAN MAN NAG MAN MAN n/a n/a
20 2OW6 ic50 = 2 mM NK1 C8 H15 O3 S C1C[C@@H](....
21 3BUP - MAN C6 H12 O6 C([C@@H]1[....
22 3EJT ic50 = 44 nM HN6 C20 H31 N O3 CC(C)(C)c1....
23 3CZS - MAN C6 H12 O6 C([C@@H]1[....
24 3DX1 Ki = 265 uM YHO C5 H11 N O3 C1[C@H]([C....
25 2F7P Ki = 0.249 uM 2SK C13 H19 N O3 S CS[C@@H]1[....
26 3EJP Ki = 2.8 nM HN2 C16 H21 N O4 c1ccc(cc1)....
27 3BVV - YZ0 MAN Z4Y n/a n/a
28 2F18 ic50 = 80 uM GB1 C13 H20 N2 O3 c1ccc(cc1)....
29 3DX4 Ki = 76 nM GOO C6 H13 N O4 CO[C@@H]1[....
30 2F1A ic50 = 720 uM GB2 C13 H20 N2 O3 c1ccc(cc1)....
31 3D4Y Ki = 2 uM MVL C8 H12 N2 O4 c1cn2c(n1)....
32 3DDF Ki = 67 uM GB6 C13 H18 N2 O4 c1ccc(cc1)....
33 1TQT ic50 ~ 7.5 mM SSD C9 H18 O9 S2 C1[C@H]([C....
34 3DX3 Ki = 300 nM YTB C5 H11 N O4 C1([C@H]([....
35 3BUQ - MAN C6 H12 O6 C([C@@H]1[....
36 3EJR Ki = 2.7 nM HN4 C20 H29 N O4 CC(C)(C)c1....
37 1R34 ic50 = 0.9 mM LKS C14 H20 N2 O4 S [H]/N=C(/C....
38 3BVX - YZ0 MAN MAN NAG MAN n/a n/a
39 1HWW ic50 = 20 nM SWA C8 H15 N O3 C1C[C@H]([....
40 3EJQ Ki = 2.7 nM HN3 C17 H23 N O4 Cc1ccc(cc1....
41 3D50 Ki = 17 uM OEV C15 H29 N O4 CCCCCCCCN[....
42 2F1B ic50 = 1000 uM GB3 C14 H22 N2 O3 C[C@@H]1[C....
43 1R33 ic50 = 0.07 mM LKA C6 H13 N O4 S C([C@@H]1[....
44 1TQW ic50 ~ 7.5 mM BLT C9 H18 O9 S Se C1[C@H]([C....
45 3BVT - Z4R MAN n/a n/a
46 3BVU - Z4R MAN MAN n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: MZB; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 MZB 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: MZB; Similar ligands found: 724
No: Ligand Similarity coefficient
1 MSN 0.9676
2 GOO 0.9603
3 3HA 0.9479
4 DBH 0.9423
5 SAL 0.9393
6 JBK 0.9390
7 FE DB1 0.9384
8 FBT 0.9381
9 3M0 0.9378
10 3F0 0.9371
11 BE2 0.9362
12 6M1 0.9342
13 JKE 0.9335
14 GRE 0.9333
15 NOJ 0.9322
16 G5V 0.9313
17 6F0 0.9311
18 Z6J 0.9311
19 94B 0.9271
20 HHA 0.9269
21 G3F 0.9248
22 MAN 0.9243
23 ES6 0.9234
24 2ZV 0.9231
25 RIB 0.9226
26 4P0 0.9222
27 Q6T 0.9220
28 BGC 0.9219
29 INS 0.9216
30 K5W 0.9206
31 3U4 0.9205
32 BMA 0.9201
33 42C 0.9199
34 MNM 0.9199
35 4SV 0.9194
36 LGC 0.9193
37 GTQ 0.9187
38 3IT 0.9178
39 4AA 0.9177
40 JBE 0.9176
41 GLC 0.9175
42 AGK 0.9166
43 SJ5 0.9164
44 FBV 0.9163
45 JZ3 0.9162
46 CN0 0.9162
47 7WV 0.9162
48 23A 0.9161
49 ISE 0.9161
50 GLF 0.9161
51 AHR 0.9154
52 5CU 0.9152
53 1WD 0.9152
54 9TZ 0.9149
55 LCN 0.9142
56 FA0 0.9138
57 SHG 0.9135
58 AKH 0.9133
59 GCS 0.9129
60 DOB 0.9128
61 GIF 0.9125
62 5RG 0.9124
63 GAB 0.9120
64 HJP 0.9119
65 IFL 0.9118
66 82I 0.9117
67 PXL 0.9115
68 DQN 0.9114
69 LYL 0.9113
70 KFH 0.9112
71 32O 0.9109
72 NK 0.9106
73 7HQ 0.9104
74 BHA 0.9103
75 WOO 0.9100
76 R8A 0.9099
77 FRU 0.9099
78 KYD 0.9098
79 8S0 0.9098
80 RNS 0.9097
81 3FH 0.9097
82 3NT 0.9095
83 ASC 0.9093
84 FUL 0.9093
85 3HB 0.9092
86 OVV 0.9091
87 DMJ 0.9090
88 9DG 0.9090
89 X05 0.9087
90 IBF 0.9087
91 FYU 0.9086
92 5M0 0.9085
93 7NI 0.9084
94 5WY 0.9083
95 H76 0.9078
96 IJZ 0.9077
97 54G 0.9076
98 NOY 0.9073
99 3SK 0.9073
100 KJY 0.9072
101 RPQ 0.9071
102 RIP 0.9071
103 XYS 0.9069
104 FOT 0.9064
105 53C 0.9064
106 MMA 0.9063
107 KBB 0.9060
108 P3K 0.9058
109 G6D 0.9057
110 0MK 0.9057
111 FB1 0.9056
112 I3A 0.9055
113 TEP 0.9054
114 M1Q 0.9051
115 VNJ 0.9048
116 ASO 0.9046
117 3AB 0.9046
118 8GC 0.9044
119 39A 0.9043
120 KBG 0.9038
121 9KT 0.9037
122 GYE 0.9034
123 FP1 0.9031
124 5NU 0.9030
125 AZF 0.9029
126 GXL 0.9028
127 HFB 0.9027
128 CTS 0.9027
129 GUN 0.9026
130 4M0 0.9025
131 5HN 0.9025
132 UNC 0.9025
133 4NG 0.9025
134 SWA 0.9023
135 286 0.9023
136 GAL 0.9021
137 INO 0.9018
138 G2F 0.9018
139 DIE 0.9016
140 2ZQ 0.9016
141 25W 0.9015
142 5MK 0.9014
143 F5B 0.9012
144 ISD 0.9011
145 7ZE 0.9011
146 C2U 0.9009
147 B57 0.9008
148 0R0 0.9008
149 ARW 0.9007
150 LXC 0.9007
151 329 0.9006
152 IFM 0.9006
153 DGJ 0.9003
154 XXP 0.9000
155 ZXD 0.9000
156 SHA 0.8993
157 PFB 0.8992
158 YTB 0.8990
159 JUG 0.8990
160 BDP 0.8989
161 XAN 0.8989
162 GLA 0.8988
163 1U6 0.8986
164 3XX 0.8986
165 RNT 0.8986
166 NQ 0.8985
167 NID 0.8985
168 TTY 0.8984
169 G1O 0.8980
170 SVD 0.8980
171 ZWZ 0.8979
172 AZA 0.8976
173 GIV 0.8976
174 ORO 0.8974
175 6CS 0.8973
176 4NC 0.8971
177 CFF 0.8970
178 SX1 0.8969
179 5RN 0.8969
180 ICO 0.8969
181 SR1 0.8968
182 UEG 0.8968
183 32X 0.8966
184 IP0 0.8966
185 DRL 0.8965
186 OXZ 0.8965
187 PCI 0.8964
188 YSO 0.8963
189 HQD 0.8963
190 F81 0.8962
191 495 0.8962
192 AJ2 0.8962
193 Q24 0.8961
194 F3B 0.8960
195 DHB 0.8956
196 CTL 0.8956
197 XQG 0.8955
198 3DM 0.8954
199 RXA 0.8954
200 0N7 0.8954
201 R2B 0.8953
202 LI6 0.8952
203 4HC 0.8952
204 1LQ 0.8952
205 ARA 0.8950
206 M5K 0.8950
207 XYP 0.8949
208 24W 0.8948
209 DHQ 0.8948
210 2LY 0.8948
211 4ME 0.8947
212 BCF 0.8946
213 93K 0.8946
214 6AP 0.8944
215 ADZ 0.8944
216 2HO 0.8944
217 NMJ 0.8944
218 1SQ 0.8943
219 SF9 0.8942
220 OMD 0.8942
221 HMU 0.8941
222 1NP 0.8940
223 GDE 0.8938
224 J9W 0.8937
225 261 0.8937
226 3WA 0.8935
227 MEW 0.8935
228 2XX 0.8935
229 3BZ 0.8935
230 NNO 0.8935
231 FHB 0.8933
232 4A3 0.8931
233 NIO 0.8931
234 BEZ 0.8930
235 PXM 0.8930
236 AQO 0.8929
237 B53 0.8928
238 MT5 0.8928
239 AFR 0.8927
240 VK3 0.8927
241 3HM 0.8927
242 5CL 0.8926
243 WCE 0.8926
244 GCU 0.8925
245 141 0.8925
246 KOJ 0.8925
247 INE 0.8924
248 3ID 0.8924
249 SFU 0.8924
250 EYK 0.8922
251 HZQ 0.8921
252 BBF 0.8921
253 EVA 0.8920
254 XX2 0.8920
255 XCZ 0.8920
256 M2K 0.8918
257 FUC 0.8918
258 RAM 0.8918
259 BEN 0.8917
260 60P 0.8917
261 PYQ 0.8917
262 289 0.8917
263 OXC 0.8917
264 JBQ 0.8916
265 N5J 0.8916
266 MFU 0.8914
267 BAM 0.8913
268 IGA 0.8913
269 A2F 0.8913
270 JPZ 0.8913
271 MT0 0.8912
272 HH5 0.8912
273 AZ9 0.8911
274 FDB 0.8910
275 6GU 0.8910
276 HMH 0.8910
277 N8P 0.8908
278 PE0 0.8907
279 M6N 0.8907
280 NCA 0.8905
281 7B4 0.8904
282 1XM 0.8904
283 LKA 0.8904
284 X6X 0.8904
285 948 0.8902
286 GAF 0.8902
287 X09 0.8901
288 AZG 0.8901
289 6PC 0.8901
290 FUB 0.8900
291 2H5 0.8899
292 2FG 0.8898
293 5IQ 0.8897
294 ES1 0.8897
295 2LP 0.8896
296 BRT 0.8896
297 JBH 0.8894
298 BDF 0.8894
299 680 0.8893
300 PBC 0.8893
301 LDU 0.8893
302 VNL 0.8892
303 P9P 0.8892
304 67N 0.8892
305 37T 0.8892
306 MO8 0.8892
307 12B 0.8890
308 YH7 0.8890
309 R1X 0.8888
310 SOE 0.8888
311 3MG 0.8887
312 1LM 0.8886
313 FUF 0.8886
314 1LN 0.8886
315 AZ8 0.8885
316 DBX 0.8885
317 DFU 0.8884
318 4YS 0.8884
319 6M9 0.8883
320 BTE 0.8883
321 HLZ 0.8882
322 5QX 0.8882
323 MFB 0.8881
324 OVM 0.8881
325 DFB 0.8880
326 290 0.8880
327 KP6 0.8879
328 0CU 0.8878
329 NDH 0.8878
330 HQY 0.8877
331 NBZ 0.8876
332 FH2 0.8876
333 UNU 0.8874
334 PRZ 0.8874
335 5SG 0.8874
336 PA1 0.8874
337 FBW 0.8874
338 2AL 0.8872
339 TFU 0.8871
340 KIB 0.8871
341 NTN 0.8870
342 3OC 0.8870
343 MYJ 0.8870
344 GCV 0.8870
345 EXO 0.8869
346 12Q 0.8869
347 CFP 0.8869
348 DX4 0.8867
349 5WX 0.8865
350 5RO 0.8863
351 3Z8 0.8862
352 PZA 0.8861
353 EA1 0.8861
354 MBG 0.8860
355 G4D 0.8860
356 PYG 0.8858
357 XX3 0.8858
358 QSB 0.8857
359 O72 0.8857
360 CGB 0.8856
361 8XQ 0.8855
362 3Z7 0.8852
363 9MG 0.8852
364 GV9 0.8852
365 HIO 0.8852
366 IF7 0.8851
367 4CS 0.8850
368 E7Z 0.8850
369 KJH 0.8850
370 TBS 0.8849
371 2EC 0.8849
372 9TW 0.8849
373 8EZ 0.8849
374 2D0 0.8847
375 AW5 0.8846
376 ARB 0.8846
377 XXR 0.8846
378 JXN 0.8845
379 34D 0.8845
380 FHN 0.8845
381 5OB 0.8844
382 6MH 0.8842
383 J9T 0.8841
384 F05 0.8839
385 CHB 0.8839
386 SVN 0.8839
387 4XH 0.8837
388 ZB1 0.8837
389 OW4 0.8837
390 DHK 0.8835
391 QPR 0.8835
392 LSA 0.8835
393 GCB 0.8834
394 3CE 0.8832
395 5Q0 0.8832
396 2CK 0.8831
397 SRT 0.8831
398 COU 0.8830
399 NEQ 0.8830
400 GIO 0.8829
401 SKM 0.8829
402 2CM 0.8826
403 M1H 0.8824
404 LT2 0.8824
405 ZZT 0.8823
406 ISN 0.8822
407 44V 0.8821
408 DIU 0.8820
409 260 0.8819
410 EDG 0.8819
411 2CQ 0.8818
412 MBD 0.8818
413 DZX 0.8818
414 SEP 0.8817
415 1GN 0.8817
416 TAG 0.8816
417 G3E 0.8815
418 QSC 0.8815
419 ALL 0.8814
420 FDK 0.8814
421 BOA 0.8814
422 K17 0.8814
423 GMN 0.8814
424 HXX 0.8813
425 XQ0 0.8811
426 9EW 0.8811
427 OHP 0.8811
428 92P 0.8810
429 2MY 0.8809
430 GAG 0.8808
431 92K 0.8808
432 CFI 0.8807
433 2AQ 0.8807
434 7VS 0.8807
435 45C 0.8806
436 QBK 0.8806
437 2C9 0.8806
438 R9S 0.8804
439 3MB 0.8802
440 LZM 0.8801
441 GZL 0.8799
442 F31 0.8799
443 XXG 0.8799
444 3RK 0.8798
445 BSX 0.8797
446 M1A 0.8797
447 64K 0.8797
448 C2Y 0.8795
449 F12 0.8794
450 6M4 0.8794
451 URC 0.8790
452 TH7 0.8790
453 7W1 0.8790
454 DMD 0.8790
455 FCB 0.8790
456 HQT 0.8789
457 IHB 0.8789
458 M0W 0.8788
459 NPY 0.8786
460 DOR 0.8785
461 APZ 0.8785
462 ES7 0.8784
463 H42 0.8784
464 5AC 0.8784
465 IPZ 0.8783
466 DBJ 0.8782
467 LNR 0.8782
468 ADA 0.8781
469 TAR 0.8780
470 IPB 0.8777
471 IMR 0.8776
472 6ME 0.8776
473 SE2 0.8776
474 PHH 0.8775
475 GYP 0.8774
476 JZ4 0.8774
477 KIA 0.8774
478 KKN 0.8772
479 QUZ 0.8772
480 7HP 0.8772
481 M58 0.8771
482 0P6 0.8771
483 3MH 0.8770
484 5QY 0.8769
485 MS9 0.8768
486 3MC 0.8768
487 OCH 0.8768
488 03V 0.8767
489 8CM 0.8766
490 BEA 0.8766
491 ADE 0.8766
492 150 0.8765
493 MHK 0.8764
494 6LW 0.8764
495 3MA 0.8764
496 CWS 0.8764
497 PSV 0.8763
498 EUG 0.8762
499 M0Q 0.8761
500 SWD 0.8761
501 Q88 0.8761
502 293 0.8760
503 FLM 0.8760
504 PBR 0.8760
505 0HO 0.8760
506 LAO 0.8759
507 3FA 0.8758
508 M1E 0.8756
509 DHS 0.8756
510 0RW 0.8755
511 NTZ 0.8754
512 KGK 0.8754
513 0HN 0.8753
514 SYA 0.8751
515 069 0.8750
516 42A 0.8749
517 RAT 0.8749
518 1P3 0.8748
519 8WO 0.8748
520 BHO 0.8748
521 EKZ 0.8747
522 UQ 0.8747
523 ES4 0.8747
524 PM6 0.8746
525 EMZ 0.8746
526 9DA 0.8745
527 BZX 0.8744
528 AC0 0.8744
529 10L 0.8743
530 3NY 0.8743
531 6NT 0.8743
532 NTM 0.8742
533 2DR 0.8740
534 RM4 0.8740
535 QX4 0.8739
536 DCO 0.8739
537 1PT 0.8739
538 7B3 0.8738
539 H62 0.8738
540 149 0.8738
541 BNS 0.8737
542 VGL 0.8737
543 HPA 0.8737
544 BZ3 0.8736
545 GIM 0.8735
546 MWP 0.8734
547 NDM 0.8733
548 TSS 0.8733
549 MIC 0.8732
550 BP1 0.8732
551 SS1 0.8730
552 H33 0.8729
553 PMB 0.8728
554 8H8 0.8728
555 B62 0.8728
556 SKA 0.8728
557 GLT 0.8727
558 6MP 0.8726
559 FFP 0.8726
560 I1N 0.8724
561 HQ9 0.8723
562 ZZ3 0.8723
563 BNT 0.8721
564 7MH 0.8720
565 1XN 0.8720
566 1F1 0.8720
567 PAB 0.8718
568 FAN 0.8718
569 KUF 0.8718
570 3PF 0.8717
571 209 0.8716
572 24B 0.8716
573 PDC 0.8716
574 X0V 0.8714
575 V55 0.8714
576 FSW 0.8714
577 TLA 0.8712
578 4ZC 0.8712
579 4SX 0.8712
580 JFD 0.8711
581 F0J 0.8711
582 B55 0.8709
583 8TX 0.8709
584 97T 0.8708
585 PRF 0.8707
586 JZ1 0.8707
587 NPO 0.8706
588 XHP 0.8705
589 ODO 0.8705
590 9HX 0.8704
591 D1X 0.8703
592 TTL 0.8702
593 TRA 0.8702
594 7N0 0.8700
595 DUB 0.8699
596 H6B 0.8697
597 B0D 0.8697
598 12M 0.8697
599 NSP 0.8697
600 95Z 0.8695
601 YIO 0.8694
602 LDP 0.8694
603 3DO 0.8694
604 D3M 0.8694
605 2CL 0.8693
606 94N 0.8690
607 J9Q 0.8689
608 4P5 0.8688
609 JTH 0.8687
610 N7P 0.8684
611 6HQ 0.8682
612 PBZ 0.8682
613 RM1 0.8682
614 DQU 0.8681
615 0LH 0.8680
616 51R 0.8680
617 AIN 0.8679
618 7VJ 0.8679
619 PZI 0.8678
620 PHT 0.8677
621 QSH 0.8676
622 GLY PRO 0.8675
623 PHB 0.8674
624 YCP 0.8674
625 GOX 0.8674
626 IPM 0.8673
627 3BU 0.8671
628 FB2 0.8671
629 A13 0.8671
630 F1A 0.8670
631 NVU 0.8668
632 AMG 0.8666
633 CDV 0.8666
634 OVP 0.8663
635 P72 0.8663
636 7WA 0.8663
637 4RW 0.8662
638 AC6 0.8661
639 GLU 0.8661
640 7D2 0.8661
641 4HM 0.8657
642 HY3 0.8654
643 GTR 0.8653
644 2ZM 0.8653
645 ABI 0.8652
646 IV2 0.8651
647 1AB 0.8650
648 ISZ 0.8649
649 RHU 0.8648
650 CWM 0.8642
651 IFP 0.8642
652 IT9 0.8642
653 1Y6 0.8641
654 TIU 0.8639
655 SEJ 0.8638
656 4TU 0.8637
657 HBA 0.8636
658 NIZ 0.8636
659 VOH 0.8634
660 WBU 0.8631
661 AEZ 0.8628
662 UAN 0.8627
663 PCA 0.8625
664 MVL 0.8623
665 1XX 0.8619
666 3AL 0.8619
667 SW7 0.8618
668 TDR 0.8616
669 6VD 0.8616
670 HBD 0.8615
671 HA7 0.8614
672 Z5P 0.8613
673 PAC 0.8613
674 REL 0.8610
675 4MA 0.8609
676 ALA PRO 0.8607
677 6NI 0.8607
678 4XR 0.8605
679 7ME 0.8604
680 7A8 0.8602
681 4PW 0.8600
682 3R6 0.8598
683 GXY 0.8597
684 FPK 0.8596
685 7WR 0.8594
686 4XV 0.8594
687 JAW 0.8593
688 SYN 0.8592
689 3A9 0.8591
690 HTP 0.8591
691 GTL 0.8590
692 Z82 0.8584
693 TZE 0.8584
694 T6C 0.8584
695 23J 0.8584
696 FCA 0.8581
697 IT2 0.8580
698 8WT 0.8580
699 MJ2 0.8577
700 PQK 0.8577
701 4JT 0.8577
702 HBX 0.8577
703 X1E 0.8576
704 URF 0.8575
705 SXS 0.8574
706 5NI 0.8572
707 AOS 0.8564
708 MR1 0.8562
709 4JQ 0.8562
710 LFR 0.8560
711 KJU 0.8558
712 PHU 0.8556
713 RB5 0.8556
714 XYL 0.8556
715 TSU 0.8555
716 2PG 0.8539
717 SOR 0.8537
718 SRO 0.8532
719 JKZ 0.8531
720 JB8 0.8530
721 ABE 0.8530
722 282 0.8528
723 IDH 0.8526
724 QAT 0.8522
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3EJR; Ligand: HN4; 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: 3ejr.bio1) has 34 residues
No: Leader PDB Ligand Sequence Similarity
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