Receptor
PDB id Resolution Class Description Source Keywords
3dx3 1.42 Å EC: 3.2.1.114 GOLGI ALPHA-MANNOSIDASE II IN COMPLEX WITH MANNOSTATIN ANALO 3S,4R,5R)-5-AMINOCYCLOPENTANE-1,2,3,4-TETRAOL DROSOPHILA MELANOGASTER GH38 GLYCOSIDASE GLYCOSIDASE GOLGI APPARATUS HYDROLASE MMETAL-BINDING SIGNAL-ANCHOR TRANSMEMBRANE
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
MRD A:1049;
Invalid;
none;
submit data
118.174 C6 H14 O2 C[C@H...
NAG A:1046;
Invalid;
none;
submit data
221.208 C8 H15 N O6 CC(=O...
PO4 A:1048;
Invalid;
none;
submit data
94.971 O4 P [O-]P...
YTB A:1050;
Valid;
none;
Ki = 300 nM
149.145 C5 H11 N O4 C1([C...
ZN A:1047;
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: YTB; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 YTB 1 1
2 GOO 0.428571 0.892857
3 INS 0.416667 0.615385
4 MSN 0.409091 0.833333
Similar Ligands (3D)
Ligand no: 1; Ligand: YTB; Similar ligands found: 668
No: Ligand Similarity coefficient
1 XYS 0.9728
2 YHO 0.9693
3 XYP 0.9661
4 RIP 0.9646
5 FUC 0.9618
6 DFU 0.9590
7 0MK 0.9586
8 LXC 0.9555
9 64K 0.9550
10 ARA 0.9550
11 FUL 0.9546
12 FUF 0.9522
13 PYG 0.9508
14 1XX 0.9499
15 AHR 0.9490
16 ARB 0.9477
17 CAQ 0.9470
18 3MC 0.9466
19 FLM 0.9465
20 MBD 0.9465
21 RAM 0.9442
22 0TR 0.9441
23 2C9 0.9433
24 FFP 0.9433
25 3FA 0.9432
26 3MH 0.9425
27 FCA 0.9408
28 GMN 0.9398
29 2MY 0.9387
30 SEJ 0.9379
31 3CE 0.9379
32 JZ0 0.9378
33 XXR 0.9371
34 TM4 0.9370
35 8LG 0.9369
36 L89 0.9367
37 93Q 0.9367
38 92Z 0.9363
39 FP2 0.9362
40 OXE 0.9358
41 URF 0.9358
42 1AN 0.9357
43 76X 0.9356
44 TMT 0.9353
45 6MH 0.9353
46 TAR 0.9353
47 WBU 0.9352
48 2AF 0.9352
49 BEW 0.9352
50 2CM 0.9346
51 6HQ 0.9336
52 DUB 0.9330
53 XBZ 0.9330
54 7CZ 0.9330
55 ADE 0.9320
56 938 0.9320
57 JZ3 0.9316
58 3XX 0.9314
59 40O 0.9313
60 G6D 0.9312
61 2CH 0.9310
62 2XX 0.9306
63 BGC 0.9304
64 HPA 0.9302
65 CGB 0.9300
66 TDR 0.9299
67 HTS 0.9292
68 RNS 0.9290
69 6MP 0.9288
70 YAN 0.9286
71 4ZE 0.9286
72 F5B 0.9282
73 Z6J 0.9282
74 7HP 0.9281
75 ES4 0.9281
76 FCB 0.9280
77 BTE 0.9280
78 MWM 0.9274
79 SWD 0.9267
80 A1U 0.9264
81 AGK 0.9263
82 MFB 0.9260
83 9HX 0.9259
84 TM7 0.9259
85 MCT 0.9254
86 3ZQ 0.9253
87 PYD 0.9247
88 ICP 0.9247
89 ABE 0.9246
90 PM6 0.9246
91 9DA 0.9246
92 4HO 0.9243
93 1MC 0.9239
94 23A 0.9237
95 2AC 0.9236
96 XYD 0.9234
97 H76 0.9231
98 2YU 0.9224
99 TH0 0.9223
100 RIB 0.9223
101 3RK 0.9223
102 2MP 0.9222
103 XLS 0.9222
104 URA 0.9220
105 34A 0.9219
106 7WA 0.9218
107 G2F 0.9217
108 RM4 0.9217
109 BP1 0.9213
110 HT4 0.9212
111 NK 0.9209
112 5UC 0.9209
113 IF7 0.9207
114 26D 0.9206
115 DFB 0.9201
116 RSF 0.9201
117 GLC 0.9195
118 94N 0.9195
119 TMZ 0.9194
120 OXQ 0.9194
121 275 0.9192
122 9TY 0.9192
123 MZG 0.9188
124 GIF 0.9187
125 EXO 0.9185
126 PAV 0.9183
127 BR9 0.9181
128 43M 0.9180
129 4JJ 0.9179
130 10L 0.9178
131 DGJ 0.9177
132 MNM 0.9175
133 27Y 0.9175
134 5JC 0.9175
135 F05 0.9174
136 CRS 0.9174
137 4CL 0.9165
138 0R0 0.9164
139 6X8 0.9164
140 0CT 0.9161
141 IDM 0.9161
142 GAL 0.9160
143 NOJ 0.9160
144 4XX 0.9156
145 MAK 0.9156
146 SAL 0.9155
147 CYT 0.9155
148 H3M 0.9155
149 LG3 0.9153
150 GIO 0.9151
151 L3Q 0.9150
152 25W 0.9149
153 RCO 0.9149
154 MFU 0.9143
155 IFM 0.9143
156 BMA 0.9143
157 8GF 0.9142
158 4PW 0.9140
159 AZF 0.9138
160 XUL 0.9138
161 9EW 0.9132
162 JZ2 0.9132
163 6LW 0.9131
164 MWJ 0.9131
165 150 0.9130
166 286 0.9130
167 GBD 0.9128
168 ARW 0.9126
169 BDR 0.9125
170 4JO 0.9123
171 M1A 0.9123
172 5MH 0.9121
173 FUB 0.9120
174 3CH 0.9119
175 R8A 0.9117
176 1WG 0.9116
177 HGQ 0.9116
178 MLT 0.9116
179 BVF 0.9114
180 IND 0.9113
181 WOO 0.9112
182 0R1 0.9111
183 GVH 0.9109
184 DEN 0.9109
185 OXZ 0.9109
186 QOS 0.9105
187 IFL 0.9105
188 HPY 0.9102
189 2H5 0.9102
190 LG5 0.9100
191 ADZ 0.9098
192 82I 0.9096
193 EQT 0.9096
194 BZF 0.9096
195 QFH 0.9091
196 GCS 0.9089
197 FYU 0.9089
198 R1X 0.9089
199 R2B 0.9089
200 ISE 0.9088
201 Y8I 0.9088
202 ALO 0.9088
203 BZI 0.9085
204 DUC 0.9084
205 5AC 0.9084
206 ADK 0.9083
207 3MA 0.9083
208 4DX 0.9083
209 4JP 0.9081
210 IDH 0.9080
211 PBE 0.9077
212 6KX 0.9077
213 GLF 0.9075
214 MB3 0.9074
215 DMJ 0.9070
216 TLD 0.9070
217 948 0.9068
218 ICC 0.9066
219 3Z7 0.9064
220 34V 0.9062
221 KYD 0.9062
222 MPI 0.9061
223 IMR 0.9060
224 MAN 0.9059
225 VAL 0.9058
226 1LQ 0.9058
227 LCN 0.9058
228 ECE 0.9058
229 1PT 0.9057
230 FRU 0.9056
231 P3K 0.9055
232 2FG 0.9055
233 JBE 0.9054
234 ALL 0.9053
235 PAF 0.9053
236 JZ1 0.9052
237 FPY 0.9051
238 LDU 0.9051
239 2ZV 0.9051
240 F81 0.9049
241 GRE 0.9049
242 285 0.9048
243 JZ9 0.9048
244 67N 0.9046
245 6F0 0.9045
246 FPK 0.9044
247 LZ1 0.9044
248 AFR 0.9043
249 8EZ 0.9042
250 THR 0.9042
251 TLA 0.9040
252 7W4 0.9040
253 2CQ 0.9038
254 5Q0 0.9038
255 KPL 0.9038
256 T6C 0.9036
257 O72 0.9035
258 CIG 0.9035
259 HLR 0.9035
260 LRH 0.9034
261 6UA 0.9032
262 GLA 0.9028
263 BZX 0.9026
264 0RW 0.9025
265 6M4 0.9025
266 3WA 0.9025
267 5SG 0.9024
268 HQY 0.9024
269 6AI 0.9023
270 IUR 0.9022
271 3M0 0.9020
272 3U4 0.9020
273 1NP 0.9017
274 KKN 0.9017
275 KSW 0.9017
276 X6X 0.9016
277 HH8 0.9015
278 260 0.9015
279 1DW 0.9013
280 45C 0.9011
281 BE2 0.9010
282 NOY 0.9009
283 IPH 0.9008
284 94B 0.9007
285 4XH 0.9006
286 4ZC 0.9005
287 4YS 0.9005
288 PA1 0.9005
289 PXL 0.9005
290 GAG 0.9005
291 SOE 0.9004
292 ASO 0.9004
293 4H2 0.9003
294 DTI 0.9000
295 1LM 0.9000
296 7MH 0.9000
297 60P 0.8999
298 7B4 0.8998
299 F4Z 0.8998
300 39A 0.8998
301 ISN 0.8998
302 284 0.8996
303 24W 0.8996
304 EDG 0.8996
305 1SQ 0.8994
306 GUN 0.8994
307 GAF 0.8992
308 ES1 0.8992
309 MZB 0.8990
310 JFD 0.8989
311 JPZ 0.8988
312 SVN 0.8988
313 4SV 0.8985
314 KIV 0.8982
315 5IQ 0.8982
316 4XR 0.8980
317 ES6 0.8978
318 DZX 0.8977
319 HEW 0.8972
320 BEZ 0.8971
321 NEQ 0.8970
322 M3T 0.8967
323 RUU 0.8966
324 9DG 0.8965
325 HY3 0.8965
326 5WX 0.8963
327 UEG 0.8957
328 JBH 0.8954
329 KBG 0.8953
330 LER 0.8952
331 B3R 0.8952
332 2CK 0.8950
333 I1N 0.8949
334 ASP 0.8944
335 BDF 0.8943
336 JIF 0.8942
337 N5J 0.8940
338 HH5 0.8940
339 3DY 0.8940
340 YIO 0.8939
341 GXL 0.8939
342 TC7 0.8935
343 ES7 0.8934
344 MBG 0.8934
345 FX1 0.8933
346 G3F 0.8930
347 280 0.8928
348 BEN 0.8928
349 KJY 0.8928
350 5CL 0.8927
351 3SK 0.8926
352 B53 0.8924
353 ZZT 0.8924
354 NCA 0.8923
355 1GN 0.8921
356 XAN 0.8919
357 5WV 0.8919
358 NPY 0.8919
359 1WD 0.8919
360 3HA 0.8915
361 QUZ 0.8914
362 PXM 0.8913
363 8H8 0.8913
364 DAB 0.8912
365 3F0 0.8912
366 AZA 0.8911
367 PLQ 0.8911
368 5MB 0.8911
369 HMH 0.8910
370 SF9 0.8910
371 6M9 0.8909
372 2K4 0.8908
373 6AP 0.8907
374 5RG 0.8906
375 DA1 0.8903
376 HQE 0.8901
377 FPN 0.8898
378 5MI 0.8897
379 6M1 0.8897
380 5H1 0.8897
381 J1Z 0.8895
382 1XN 0.8895
383 WDL 0.8894
384 FLA 0.8894
385 ES9 0.8893
386 G4D 0.8893
387 5DI 0.8892
388 IGA 0.8891
389 7HQ 0.8891
390 GIV 0.8889
391 MMZ 0.8888
392 CEJ 0.8888
393 3DM 0.8887
394 HHQ 0.8887
395 TMH 0.8886
396 JBQ 0.8886
397 HXX 0.8884
398 7EX 0.8882
399 149 0.8880
400 14O 0.8878
401 23W 0.8878
402 1AB 0.8877
403 CXL 0.8877
404 MMA 0.8876
405 270 0.8872
406 A2F 0.8872
407 KOJ 0.8871
408 290 0.8870
409 HMU 0.8870
410 A2Q 0.8868
411 CYH 0.8867
412 F60 0.8866
413 JKE 0.8863
414 95Z 0.8862
415 LG4 0.8862
416 O7U 0.8861
417 PCR 0.8860
418 BCP 0.8859
419 SFU 0.8858
420 V1L 0.8858
421 25R 0.8857
422 9MG 0.8855
423 RP7 0.8855
424 141 0.8855
425 H4N 0.8855
426 ASC 0.8853
427 1XM 0.8853
428 DIG 0.8851
429 SWA 0.8851
430 32O 0.8850
431 282 0.8850
432 AZG 0.8849
433 GTQ 0.8848
434 NBZ 0.8847
435 M2H 0.8846
436 PXY 0.8846
437 CFP 0.8846
438 CRN 0.8843
439 11S 0.8842
440 ITN 0.8841
441 I3A 0.8841
442 M1E 0.8840
443 G5V 0.8839
444 7WV 0.8838
445 CAM 0.8838
446 AX2 0.8837
447 HRZ 0.8836
448 FK1 0.8836
449 VAH 0.8834
450 4AP 0.8834
451 SF6 0.8833
452 HVK 0.8833
453 13X 0.8831
454 DX4 0.8831
455 24B 0.8830
456 VNJ 0.8830
457 AX7 0.8830
458 BOA 0.8828
459 FDK 0.8828
460 LGC 0.8827
461 HAI 0.8826
462 24T 0.8826
463 MBN 0.8826
464 SYN 0.8825
465 5M0 0.8825
466 4CH 0.8825
467 2AP 0.8824
468 9PO 0.8823
469 HSL 0.8822
470 DBH 0.8821
471 ABN 0.8820
472 DQN 0.8819
473 FH2 0.8819
474 N7P 0.8819
475 OAA 0.8819
476 B0D 0.8818
477 DIE 0.8816
478 3AP 0.8816
479 4AX 0.8815
480 7VJ 0.8815
481 35C 0.8812
482 2DR 0.8810
483 2IM 0.8810
484 LGA 0.8810
485 GYE 0.8809
486 HIO 0.8808
487 Q88 0.8808
488 WOT 0.8807
489 54G 0.8807
490 HBX 0.8806
491 N8P 0.8803
492 DMI 0.8802
493 CIZ 0.8801
494 PRO 0.8800
495 2PC 0.8800
496 3AY 0.8799
497 ILE 0.8798
498 5ZE 0.8797
499 HYN 0.8797
500 TBP 0.8796
501 HFB 0.8794
502 FPI 0.8793
503 AUD 0.8793
504 YH7 0.8793
505 ZB1 0.8792
506 XQ0 0.8791
507 6PC 0.8790
508 2ZX 0.8789
509 0CU 0.8789
510 L60 0.8787
511 HHA 0.8783
512 23B 0.8782
513 TH7 0.8780
514 DTL 0.8780
515 NIO 0.8779
516 2KT 0.8776
517 PZA 0.8775
518 NSP 0.8775
519 DSN 0.8769
520 SHG 0.8769
521 BHO 0.8768
522 PY7 0.8767
523 8NY 0.8766
524 BAM 0.8763
525 ABV 0.8762
526 ASN 0.8761
527 4HS 0.8757
528 XQG 0.8754
529 BR8 0.8753
530 AKB 0.8752
531 9TZ 0.8751
532 5QX 0.8751
533 8S0 0.8751
534 0W8 0.8751
535 8CL 0.8751
536 93B 0.8749
537 FSW 0.8749
538 4JU 0.8748
539 URQ 0.8743
540 SR1 0.8743
541 1MR 0.8741
542 TFU 0.8740
543 TFB 0.8740
544 4JN 0.8737
545 2MH 0.8736
546 MLA 0.8735
547 7D2 0.8733
548 2MI 0.8733
549 FDB 0.8733
550 4HC 0.8733
551 BML 0.8732
552 GG6 0.8730
553 PCI 0.8730
554 M1Q 0.8725
555 5MK 0.8724
556 PE0 0.8723
557 D3M 0.8722
558 12Q 0.8719
559 I2M 0.8719
560 NK2 0.8719
561 AMG 0.8719
562 MRZ 0.8719
563 NBE 0.8718
564 MT0 0.8716
565 C2A 0.8716
566 GYP 0.8715
567 UNU 0.8714
568 APY 0.8714
569 IP0 0.8713
570 RBL 0.8713
571 NMJ 0.8712
572 NTN 0.8710
573 RHU 0.8708
574 RB5 0.8708
575 HZQ 0.8708
576 HLZ 0.8707
577 MLI 0.8706
578 TTO 0.8706
579 FP1 0.8704
580 DMD 0.8702
581 7W1 0.8701
582 ZWZ 0.8700
583 CWM 0.8699
584 AZ8 0.8697
585 ZXD 0.8696
586 YSO 0.8694
587 MEW 0.8694
588 XM0 0.8692
589 6CS 0.8692
590 FAC 0.8691
591 261 0.8687
592 ERH 0.8686
593 HBA 0.8686
594 LFR 0.8685
595 HQT 0.8685
596 ES0 0.8681
597 SER 0.8680
598 IBF 0.8680
599 32X 0.8674
600 98J 0.8672
601 PYC 0.8670
602 03V 0.8670
603 FOA 0.8665
604 278 0.8665
605 7VS 0.8663
606 AC5 0.8663
607 COU 0.8662
608 GLT 0.8661
609 SJ5 0.8659
610 QSC 0.8659
611 YCP 0.8656
612 5NU 0.8654
613 3ID 0.8654
614 DGY 0.8653
615 HX3 0.8651
616 SMV 0.8651
617 4AA 0.8649
618 5CU 0.8648
619 HUI 0.8645
620 9CL 0.8642
621 3NT 0.8642
622 PCA 0.8642
623 KG7 0.8641
624 B57 0.8641
625 J9W 0.8638
626 F0J 0.8637
627 HYP 0.8637
628 PYJ 0.8636
629 IJZ 0.8633
630 MO8 0.8632
631 HZP 0.8630
632 LMR 0.8629
633 FA0 0.8626
634 1LN 0.8619
635 TZC 0.8615
636 UNC 0.8615
637 PFB 0.8613
638 MZW 0.8613
639 AMC 0.8612
640 IT2 0.8612
641 JBN 0.8611
642 3PY 0.8607
643 DBB 0.8606
644 FOT 0.8606
645 SYV 0.8605
646 SRT 0.8599
647 HSE 0.8597
648 C5J 0.8596
649 DMG 0.8594
650 4VP 0.8590
651 GTL 0.8587
652 2LP 0.8585
653 0P6 0.8578
654 SVJ 0.8577
655 M0W 0.8570
656 DOB 0.8570
657 EUG 0.8569
658 NDM 0.8563
659 PBC 0.8560
660 NPO 0.8555
661 JZ4 0.8552
662 DPR 0.8545
663 3MG 0.8540
664 V55 0.8536
665 TTL 0.8533
666 717 0.8529
667 4M0 0.8525
668 T2C 0.8509
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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