Receptor
PDB id Resolution Class Description Source Keywords
5f2p 1.8 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE BRD9 BROMODOMAIN IN COMPLEX WITH CO HOMO SAPIENS BROMODOMAIN INHIBITOR REGULATORY PROTEINS TRANSCRIPTION
Ref.: STRUCTURE-BASED DESIGN OF AN IN VIVO ACTIVE SELECTI INHIBITOR. J.MED.CHEM. V. 59 4462 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
5TY A:201;
B:201;
Valid;
Valid;
none;
none;
Kd = 37.5 uM
204.228 C10 H12 N4 O CN1C=...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5F1H 1.82 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE BRD9 BROMODAMIAN IN COMPLEX WITH BI HOMO SAPIENS BROMODOMAIN INHIBITOR TRANSCRIPTION
Ref.: STRUCTURE-BASED DESIGN OF AN IN VIVO ACTIVE SELECTI INHIBITOR. J.MED.CHEM. V. 59 4462 2016
Members (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
2 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
3 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
4 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
5 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
6 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
7 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
8 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
9 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
10 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
11 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
12 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
13 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
14 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
70% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 5I7Y Kd = 52 nM 69G C20 H21 N3 O2 C/C=C/CN1C....
2 4UIW ic50 = 0.00000001 M H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
3 4UIV ic50 = 0.00000001 M XZB C21 H20 F3 N3 O3 S2 CN1C=C(c2c....
4 5JI8 Kd = 23.4 uM 6KT C8 H7 N3 O S c1cc2c(cc1....
5 5MKY ic50 = 2 uM I0D C15 H17 Cl N4 O CN1CCc2c(c....
6 4UIU ic50 = 0.00000001 M TVU C22 H24 N2 O6 S2 CN1C=C(c2c....
7 4UIT ic50 = 0.00000001 M N1D C22 H25 N3 O6 S2 CN1C=C(c2c....
8 5I40 ic50 = 13.7 uM 67N C8 H8 N2 O CN1C=Cc2cc....
9 5I7X Kd = 53 nM 67B C17 H17 N3 O2 CN1C=C(c2c....
10 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
11 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
12 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
13 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
14 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
15 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
16 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
17 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
18 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
19 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
20 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
21 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
22 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
23 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
24 6V1E Kd = 121 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
25 6V17 Kd = 148 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
26 6V0Q Kd = 4200 nM EAE C13 H15 N O2 S CCN1c2cc(c....
27 6V1H Kd = 114 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
28 6V16 Kd = 556 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
29 6V1F Kd = 418 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
50% Homology Family (64)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 5I7Y Kd = 52 nM 69G C20 H21 N3 O2 C/C=C/CN1C....
2 4UIW ic50 = 0.00000001 M H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
3 4UIV ic50 = 0.00000001 M XZB C21 H20 F3 N3 O3 S2 CN1C=C(c2c....
4 5JI8 Kd = 23.4 uM 6KT C8 H7 N3 O S c1cc2c(cc1....
5 5MKY ic50 = 2 uM I0D C15 H17 Cl N4 O CN1CCc2c(c....
6 4UIU ic50 = 0.00000001 M TVU C22 H24 N2 O6 S2 CN1C=C(c2c....
7 4UIT ic50 = 0.00000001 M N1D C22 H25 N3 O6 S2 CN1C=C(c2c....
8 5I40 ic50 = 13.7 uM 67N C8 H8 N2 O CN1C=Cc2cc....
9 5I7X Kd = 53 nM 67B C17 H17 N3 O2 CN1C=C(c2c....
10 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
11 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
12 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
13 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
14 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
15 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
16 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
17 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
18 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
19 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
20 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
21 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
22 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
23 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
24 5E3D Kd = 95 uM 5JL C5 H4 N4 O S2 C12=C(NC(=....
25 5C87 - 4YS C9 H7 N O c1ccc2c(c1....
26 5O4T - 9KT C10 H10 N2 O2 CN1c2ccccc....
27 5OV8 Kd = 18 uM AXN C24 H30 N4 O4 S CC(C)Cc1cc....
28 5O4S ic50 = 3.4 uM 9KW C24 H28 N4 O5 S CN1c2cc(c(....
29 5MWH Kd = 1.8 uM UWX C24 H30 N4 O5 S CC(C)Cc1cc....
30 5DY7 - 5GT C9 H7 F3 N2 O c1cc2c(cc1....
31 5T4V ic50 = 60 nM N48 C19 H17 N3 O4 S CC1=CC(=O)....
32 5DYC - 5GU C8 H7 Br N2 O c1cc2c(cc1....
33 5O55 - 9L5 C19 H23 N5 O2 CCN1c2ccc(....
34 5EQ1 Kd = 21 uM BEA C9 H8 N3 S Cc1cccc2c1....
35 5G4S ic50 = 1 uM 8VI C24 H31 N5 O3 CCN(c1cc2c....
36 5EWC - 5SJ C12 H14 N2 O3 CCOC(=O)c1....
37 5EPR Kd = 91 uM 5QY C9 H10 N2 O C[C@H]1C(=....
38 5EVA - 5S9 C11 H9 F2 N3 O Cn1c(ccn1)....
39 5ETD - 5RN C10 H9 N O CC(=O)c1c[....
40 5DYA - 5GV C11 H12 N2 O3 CC[C@@H]1C....
41 5EV9 - 5SB C14 H12 N4 O CC(=O)Nc1c....
42 5MYG Kd = 31 nM LS8 C19 H17 N3 O4 S CC1=Cc2cc(....
43 5MWZ Kd = 7.1 uM KGU C24 H36 N6 O3 CCN1c2cc(c....
44 5G4R ic50 = 7.943 nM LF1 C22 H27 N5 O3 C[C@@H]1CN....
45 5OWA Kd = 3.5 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
46 5EM3 - 5Q0 C9 H7 N O c1cc2c(ccc....
47 5ETB Kd = 29 uM 5RO C11 H11 N O Cc1cccc2c1....
48 4UYE Kd = 9.54 nM 9F9 C22 H26 N4 O3 CN1c2cc(c(....
49 5O5F - 9LT C22 H20 F N5 O3 CCN1c2ccc(....
50 5O5A - 9LN C22 H21 N5 O3 CCN1c2ccc(....
51 5O5H - 9LK C17 H14 Cl N3 O3 Cc1c(oc(n1....
52 5C7N Kd = 0.27 uM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
53 5EPS Kd = 38 uM 5QX C9 H10 N2 O CN1c2ccccc....
54 5MWG ic50 = 1.7 uM WGX C25 H30 N4 O4 S CN1c2cc(c(....
55 5D7X Kd = 15 uM XZ8 C14 H13 N3 O2 CC1=C(C(=O....
56 6EKQ Kd = 10.9 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
57 6V1E Kd = 121 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
58 6V17 Kd = 148 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
59 6V0Q Kd = 4200 nM EAE C13 H15 N O2 S CCN1c2cc(c....
60 6V1H Kd = 114 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
61 6V16 Kd = 556 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
62 6V1F Kd = 418 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
63 3RCW - MB3 C5 H9 N O CN1CCCC1=O
64 5N49 ic50 = 450 nM 8LW C22 H17 N3 O3 Cc1cc2c(cc....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 5TY; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 5TY 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 5TY; Similar ligands found: 827
No: Ligand Similarity coefficient
1 V1T 0.9755
2 2K8 0.9686
3 6KT 0.9646
4 HHS 0.9637
5 68A 0.9605
6 9R5 0.9580
7 ANC 0.9550
8 6QF 0.9549
9 8HC 0.9536
10 0FK 0.9534
11 E1T 0.9520
12 12T 0.9516
13 GNM 0.9508
14 JP2 0.9504
15 AN3 0.9498
16 HNT 0.9488
17 GJP 0.9480
18 6FB 0.9479
19 SLS 0.9469
20 JG8 0.9467
21 4RU 0.9467
22 1HN 0.9460
23 0JD 0.9456
24 3R4 0.9450
25 4BL 0.9448
26 JBZ 0.9445
27 15N 0.9442
28 X48 0.9438
29 BZJ 0.9437
30 K97 0.9429
31 9ZE 0.9422
32 27B 0.9419
33 N1E 0.9415
34 KTW 0.9410
35 0FR 0.9410
36 4BY 0.9407
37 ANF 0.9403
38 FQX 0.9395
39 3VX 0.9394
40 ESX 0.9394
41 ZYR 0.9392
42 PH2 0.9391
43 AA 0.9389
44 FCD 0.9385
45 B56 0.9385
46 344 0.9384
47 X0U 0.9381
48 THA 0.9381
49 QIV 0.9378
50 DRG 0.9377
51 UNJ 0.9375
52 1KP 0.9375
53 ESP 0.9375
54 HBO 0.9375
55 3J8 0.9370
56 N8Y 0.9369
57 Y3L 0.9367
58 BP7 0.9367
59 3ZB 0.9366
60 HHR 0.9363
61 ESI 0.9361
62 8W9 0.9356
63 3VQ 0.9351
64 GO2 0.9349
65 8NX 0.9342
66 94W 0.9341
67 N91 0.9340
68 3QV 0.9334
69 TMG 0.9331
70 HBI 0.9330
71 XCG 0.9327
72 PMP 0.9326
73 FF2 0.9324
74 8ZE 0.9323
75 R9Y 0.9321
76 363 0.9319
77 ZSP 0.9316
78 ITE 0.9315
79 9CA 0.9312
80 BZ2 0.9305
81 G14 0.9305
82 BGU 0.9300
83 ICB 0.9297
84 9FL 0.9297
85 S60 0.9295
86 FDR 0.9294
87 UFO 0.9292
88 1IT 0.9291
89 N2M 0.9290
90 BPY 0.9289
91 E3X 0.9286
92 428 0.9285
93 1F1 0.9285
94 PRL 0.9285
95 CH9 0.9280
96 30G 0.9272
97 ZZA 0.9271
98 ODK 0.9259
99 PPY 0.9249
100 MSR 0.9248
101 2FQ 0.9247
102 M78 0.9247
103 2JK 0.9246
104 ALE 0.9245
105 HA5 0.9245
106 HRM 0.9245
107 5LA 0.9244
108 KDV 0.9239
109 KYA 0.9237
110 CWJ 0.9233
111 9UL 0.9233
112 BZE 0.9232
113 4I8 0.9232
114 0W1 0.9229
115 NAG 0.9229
116 AMR 0.9228
117 N2I 0.9226
118 5V7 0.9225
119 B21 0.9224
120 1A7 0.9223
121 A7H 0.9221
122 KMY 0.9218
123 H4B 0.9218
124 X11 0.9217
125 ZHA 0.9215
126 L22 0.9214
127 CLZ 0.9214
128 CK2 0.9212
129 MD6 0.9211
130 N0Z 0.9210
131 SG2 0.9207
132 MQN 0.9204
133 JTA 0.9203
134 BIK 0.9202
135 DK1 0.9201
136 TCR 0.9201
137 EUE 0.9199
138 GHM 0.9199
139 4KL 0.9197
140 PEY 0.9196
141 2J1 0.9196
142 DNA 0.9196
143 B1J 0.9195
144 54X 0.9194
145 NDD 0.9194
146 CNI 0.9193
147 JAW 0.9192
148 3VS 0.9185
149 VC3 0.9184
150 537 0.9184
151 8XL 0.9184
152 4JQ 0.9184
153 LUM 0.9183
154 5E5 0.9181
155 DNQ 0.9180
156 BIO 0.9180
157 1DR 0.9179
158 GNV 0.9178
159 CPZ 0.9178
160 A5E 0.9175
161 MS9 0.9174
162 0TU 0.9173
163 657 0.9173
164 JF8 0.9173
165 GVY 0.9172
166 1QP 0.9171
167 0HO 0.9171
168 SKF 0.9167
169 39O 0.9166
170 H5B 0.9165
171 DPT 0.9164
172 4LW 0.9164
173 JGB 0.9162
174 4HB 0.9161
175 ZYQ 0.9160
176 LR8 0.9159
177 E7S 0.9159
178 XDK 0.9159
179 5RO 0.9158
180 S0E 0.9156
181 MXD 0.9155
182 E1K 0.9152
183 SNU 0.9151
184 5WT 0.9149
185 OQC 0.9146
186 PLP 0.9144
187 ZEC 0.9142
188 TZF 0.9141
189 K68 0.9139
190 2HC 0.9138
191 KLE 0.9137
192 0SY 0.9137
193 6ZW 0.9137
194 LL1 0.9137
195 6NT 0.9131
196 4YO 0.9131
197 15E 0.9129
198 2FX 0.9128
199 0HN 0.9128
200 J6W 0.9127
201 61M 0.9126
202 ZRK 0.9126
203 1QV 0.9124
204 7O4 0.9124
205 2ZM 0.9124
206 EN1 0.9123
207 ENO 0.9121
208 G12 0.9121
209 JMG 0.9119
210 JB8 0.9118
211 5VL 0.9118
212 TIY 0.9115
213 3A9 0.9115
214 YE7 0.9113
215 JDN 0.9112
216 CXH 0.9112
217 4TU 0.9107
218 9FE 0.9107
219 EXD 0.9106
220 RKV 0.9102
221 4V2 0.9101
222 CHQ 0.9098
223 M5H 0.9098
224 A29 0.9096
225 DIN 0.9096
226 JCZ 0.9096
227 1VK 0.9094
228 H4E 0.9093
229 BPU 0.9093
230 IWT 0.9092
231 C9E 0.9092
232 AJV 0.9091
233 S98 0.9090
234 AY4 0.9089
235 5H6 0.9088
236 GO8 0.9085
237 P9E 0.9084
238 F4E 0.9084
239 QX4 0.9083
240 DNF 0.9083
241 2HU 0.9082
242 KTJ 0.9082
243 HC4 0.9081
244 5GV 0.9080
245 NRA 0.9079
246 C82 0.9077
247 LOT 0.9076
248 F5C 0.9075
249 7MX 0.9075
250 2KA 0.9074
251 2BG 0.9074
252 PUE 0.9072
253 F2W 0.9072
254 TT4 0.9072
255 MRW 0.9071
256 LQ2 0.9071
257 6FZ 0.9071
258 5GT 0.9070
259 92P 0.9070
260 78Y 0.9069
261 2WU 0.9069
262 M4E 0.9065
263 M3E 0.9064
264 YZM 0.9063
265 2QC 0.9060
266 AJY 0.9059
267 5NI 0.9059
268 APS 0.9058
269 AJ1 0.9056
270 8WT 0.9056
271 C2Y 0.9055
272 CKA 0.9055
273 ABI 0.9055
274 6NI 0.9055
275 EVF 0.9053
276 BEA 0.9052
277 TGX 0.9051
278 LFN 0.9050
279 2HQ 0.9048
280 4WL 0.9047
281 2GQ 0.9045
282 JF1 0.9045
283 PJW 0.9045
284 IAC 0.9045
285 YE6 0.9044
286 0XT 0.9042
287 3Y7 0.9042
288 0BP 0.9041
289 2LY 0.9040
290 4NB 0.9039
291 S0D 0.9039
292 L03 0.9036
293 3NY 0.9035
294 SNO 0.9035
295 DHC 0.9034
296 8NB 0.9033
297 PRF 0.9031
298 7I2 0.9029
299 7ZL 0.9026
300 DQU 0.9026
301 ZME 0.9026
302 B62 0.9023
303 6ME 0.9022
304 XIY 0.9022
305 K25 0.9022
306 AJG 0.9022
307 A5H 0.9020
308 KYN 0.9020
309 6TZ 0.9018
310 5VU 0.9016
311 6RQ 0.9016
312 36Y 0.9014
313 A7W 0.9012
314 549 0.9011
315 HX4 0.9010
316 7FU 0.9001
317 8D6 0.9000
318 2PK 0.9000
319 0FO 0.8999
320 XHP 0.8998
321 44W 0.8993
322 9KZ 0.8993
323 1M2 0.8992
324 VXX 0.8991
325 JF2 0.8990
326 IOS 0.8990
327 D9Z 0.8989
328 8MO 0.8989
329 K7H 0.8989
330 F40 0.8987
331 I3E 0.8986
332 MVN 0.8984
333 2PV 0.8980
334 9TF 0.8977
335 R20 0.8974
336 WSD 0.8972
337 BA5 0.8971
338 1Z6 0.8970
339 1L5 0.8970
340 2D2 0.8968
341 OTW 0.8968
342 BNL 0.8966
343 D48 0.8964
344 4AB 0.8964
345 9CE 0.8962
346 0N7 0.8961
347 Q0K 0.8961
348 IL5 0.8960
349 H2B 0.8960
350 JRO 0.8958
351 36E 0.8956
352 G6P 0.8956
353 GF4 0.8955
354 JA5 0.8954
355 9AP 0.8953
356 5QY 0.8948
357 KUF 0.8946
358 HQJ 0.8945
359 EYV 0.8944
360 44V 0.8940
361 WS6 0.8940
362 4FF 0.8940
363 FER 0.8939
364 3PF 0.8938
365 P81 0.8937
366 A5Q 0.8935
367 7AP 0.8932
368 86J 0.8931
369 5AD 0.8930
370 FZM 0.8930
371 GZ2 0.8928
372 28N 0.8927
373 4FE 0.8926
374 2O6 0.8924
375 L5V 0.8923
376 QMS 0.8922
377 4ME 0.8922
378 BHQ 0.8922
379 5XC 0.8921
380 6E8 0.8921
381 BQ2 0.8919
382 II4 0.8918
383 DXK 0.8918
384 PIQ 0.8917
385 LO1 0.8916
386 CX6 0.8916
387 GDL 0.8914
388 PLP PMP 0.8914
389 PZP 0.8914
390 0UL 0.8913
391 P0P 0.8912
392 LDR 0.8910
393 KJU 0.8909
394 TSS 0.8908
395 CWS 0.8908
396 A6W 0.8908
397 EGR 0.8908
398 BZ3 0.8908
399 J5I 0.8906
400 RSV 0.8905
401 WS7 0.8903
402 28A 0.8903
403 0NX 0.8898
404 IV2 0.8896
405 RA7 0.8894
406 K44 0.8893
407 M6Z 0.8892
408 APZ 0.8890
409 K2T 0.8890
410 7VP 0.8890
411 C53 0.8890
412 26C 0.8889
413 GVG 0.8887
414 N7I 0.8884
415 HQD 0.8884
416 FBF 0.8883
417 209 0.8883
418 GNY 0.8882
419 M1Z 0.8882
420 MAJ 0.8880
421 AZ9 0.8880
422 7MW 0.8878
423 FBB 0.8877
424 TCA 0.8876
425 P4L 0.8873
426 G3E 0.8873
427 F02 0.8873
428 TYL 0.8872
429 MPV 0.8872
430 4AU 0.8870
431 I2E 0.8870
432 SQ4 0.8869
433 INE 0.8868
434 0FN 0.8868
435 M2K 0.8866
436 Z21 0.8866
437 SE2 0.8866
438 5OB 0.8866
439 TXW 0.8865
440 03V 0.8865
441 IOP 0.8864
442 PNZ 0.8863
443 5OO 0.8863
444 4MB 0.8863
445 D3G 0.8863
446 4FS 0.8862
447 GJK 0.8862
448 4AA 0.8861
449 EQU 0.8861
450 HDH 0.8859
451 0F9 0.8857
452 WV7 0.8856
453 ES5 0.8854
454 F9Y 0.8852
455 H42 0.8851
456 JAH 0.8850
457 2AQ 0.8849
458 LJ3 0.8849
459 FHV 0.8848
460 4NP 0.8848
461 KW8 0.8845
462 COU 0.8845
463 X0T 0.8844
464 3AE 0.8843
465 P7Y 0.8840
466 PTS 0.8840
467 TYR 0.8839
468 EV2 0.8839
469 OCH 0.8839
470 0P6 0.8839
471 K3D 0.8837
472 BGP 0.8836
473 6VD 0.8836
474 6HP 0.8835
475 J1K 0.8835
476 PQ0 0.8834
477 5GU 0.8834
478 BHS 0.8833
479 RNO 0.8833
480 TJM 0.8832
481 2JX 0.8832
482 ANN 0.8831
483 4NZ 0.8831
484 4CN 0.8831
485 W81 0.8831
486 NDG 0.8830
487 56D 0.8830
488 SQ7 0.8829
489 6X9 0.8828
490 6P3 0.8828
491 BDP 0.8827
492 27K 0.8827
493 4P5 0.8827
494 J9N 0.8827
495 1XS 0.8827
496 K37 0.8826
497 JND 0.8826
498 TTL 0.8825
499 N4E 0.8825
500 4MU 0.8825
501 4ZA 0.8824
502 F4K 0.8823
503 8WO 0.8822
504 A5P 0.8822
505 EWG 0.8821
506 IS2 0.8821
507 22L 0.8820
508 PIM 0.8820
509 YZ9 0.8819
510 DEE 0.8819
511 1V3 0.8819
512 LR5 0.8818
513 4NO 0.8817
514 5F5 0.8817
515 FHC 0.8816
516 2QU 0.8814
517 3Z8 0.8814
518 P80 0.8813
519 795 0.8813
520 8CM 0.8813
521 KT7 0.8810
522 TWO 0.8810
523 SJK 0.8810
524 SYV 0.8810
525 LIP 0.8809
526 92G 0.8809
527 LEL 0.8809
528 VUP 0.8808
529 X0W 0.8808
530 TOF 0.8808
531 X04 0.8807
532 WUB 0.8806
533 DX2 0.8805
534 IQZ 0.8805
535 1P8 0.8804
536 VM1 0.8803
537 52C 0.8803
538 PIY 0.8802
539 CFA 0.8801
540 3D8 0.8800
541 AX3 0.8800
542 KP2 0.8799
543 6L6 0.8798
544 AES 0.8797
545 LDP 0.8797
546 9NB 0.8797
547 ZRL 0.8796
548 5RN 0.8796
549 6SD 0.8791
550 EZL 0.8790
551 DX3 0.8790
552 EE8 0.8789
553 7W1 0.8788
554 AZM 0.8788
555 SRO 0.8788
556 RYV 0.8787
557 80G 0.8786
558 833 0.8786
559 PH3 0.8785
560 36M 0.8784
561 J9T 0.8783
562 DX7 0.8783
563 ONR 0.8782
564 H33 0.8782
565 J38 0.8781
566 ES2 0.8781
567 HJ7 0.8780
568 2EC 0.8778
569 ICO 0.8778
570 2AK 0.8778
571 IPD 0.8777
572 TTY 0.8776
573 ARP 0.8775
574 PXL 0.8775
575 OLU 0.8772
576 KJH 0.8771
577 4Z4 0.8770
578 PO6 0.8770
579 SKA 0.8770
580 ODO 0.8768
581 JR2 0.8767
582 YTX 0.8766
583 AP4 0.8764
584 JWS 0.8763
585 A9B 0.8763
586 EAE 0.8763
587 M3F 0.8762
588 TRP 0.8761
589 92K 0.8761
590 CLW 0.8760
591 QBP 0.8754
592 3R6 0.8754
593 6MW 0.8754
594 KLV 0.8751
595 MR4 0.8750
596 NPX 0.8749
597 VGD 0.8748
598 8VR 0.8748
599 4NS 0.8747
600 XM5 0.8746
601 WLH 0.8744
602 ROI 0.8744
603 4M0 0.8743
604 TXQ 0.8743
605 R2P 0.8741
606 SWX 0.8740
607 39Z 0.8740
608 K82 0.8738
609 CTL 0.8737
610 4CM 0.8735
611 36R 0.8734
612 069 0.8732
613 DAH 0.8732
614 12Q 0.8731
615 BHA 0.8731
616 4R1 0.8730
617 BG6 0.8730
618 IDZ 0.8730
619 XIZ 0.8729
620 DNC 0.8726
621 8CC 0.8726
622 5NN 0.8725
623 XFE 0.8724
624 1FL 0.8724
625 URC 0.8724
626 F31 0.8724
627 DOB 0.8724
628 AP6 0.8723
629 2P3 0.8722
630 IQ5 0.8722
631 FA0 0.8721
632 GDE 0.8721
633 774 0.8720
634 N3W 0.8719
635 5VM 0.8717
636 173 0.8717
637 JTH 0.8717
638 FYR 0.8716
639 XAZ 0.8716
640 MOK 0.8716
641 ET2 0.8716
642 GI3 0.8715
643 EST 0.8715
644 JLZ 0.8713
645 NCT 0.8712
646 CCV 0.8712
647 XI7 0.8711
648 4XF 0.8711
649 NEU 0.8710
650 5QX 0.8709
651 GNJ 0.8709
652 AM4 0.8708
653 OA3 0.8708
654 SKM 0.8707
655 VNL 0.8706
656 LNR 0.8703
657 PHE 0.8703
658 HKD 0.8703
659 0DF 0.8702
660 OCZ 0.8702
661 Z5P 0.8702
662 5TZ 0.8701
663 C4E 0.8700
664 TIA 0.8700
665 HRD 0.8699
666 MFZ 0.8699
667 KLS 0.8696
668 CIY 0.8693
669 JY4 0.8692
670 H70 0.8690
671 492 0.8690
672 MUA 0.8689
673 U13 0.8689
674 NID 0.8688
675 K4V 0.8688
676 M1Q 0.8688
677 RVE 0.8687
678 ABF 0.8686
679 I3A 0.8685
680 JU2 0.8685
681 BVS 0.8685
682 EMO 0.8684
683 DPZ 0.8679
684 INO 0.8679
685 FLV 0.8679
686 FWD 0.8678
687 MEW 0.8677
688 CTE 0.8676
689 QBK 0.8675
690 B0K 0.8675
691 CZ0 0.8674
692 FMQ 0.8674
693 LZ2 0.8673
694 8TX 0.8672
695 5SJ 0.8671
696 GB4 0.8671
697 5XL 0.8670
698 1V1 0.8670
699 AQO 0.8670
700 HQT 0.8670
701 6TJ 0.8670
702 DDU 0.8668
703 4LV 0.8666
704 5NS 0.8665
705 3W8 0.8664
706 GLP 0.8664
707 1ZC 0.8664
708 5WV 0.8663
709 1V4 0.8661
710 L99 0.8661
711 PD2 0.8661
712 HCI 0.8660
713 259 0.8660
714 37T 0.8658
715 DHB 0.8658
716 5CU 0.8657
717 Q71 0.8655
718 SYA 0.8654
719 9KT 0.8654
720 4NM 0.8652
721 4GU 0.8650
722 LI6 0.8649
723 MR6 0.8646
724 AJ2 0.8645
725 A73 0.8643
726 I4D 0.8640
727 XQ0 0.8639
728 5NU 0.8638
729 NEO 0.8637
730 M5K 0.8635
731 NDH 0.8635
732 7MU 0.8635
733 0J4 0.8634
734 Q24 0.8633
735 MR5 0.8633
736 IA2 0.8633
737 FUD 0.8633
738 NNO 0.8632
739 J9W 0.8632
740 4ZF 0.8631
741 ADN 0.8631
742 TID 0.8630
743 CHB 0.8630
744 CFF 0.8629
745 FHB 0.8629
746 LT2 0.8627
747 20D 0.8626
748 BNX 0.8624
749 7WR 0.8623
750 P9P 0.8622
751 THM 0.8622
752 0J5 0.8622
753 S7J 0.8622
754 6ZE 0.8621
755 BTY 0.8620
756 V2Z 0.8620
757 B5D 0.8620
758 Q77 0.8618
759 GZV 0.8617
760 PDC 0.8616
761 EA1 0.8614
762 BZQ 0.8613
763 226 0.8613
764 Q9T 0.8611
765 18E 0.8611
766 1AJ 0.8610
767 EMZ 0.8610
768 BBY 0.8609
769 1P7 0.8609
770 I6G 0.8609
771 4A3 0.8609
772 B55 0.8606
773 2HO 0.8605
774 7B3 0.8604
775 8IG 0.8604
776 21D 0.8598
777 93K 0.8597
778 X2M 0.8597
779 PXP 0.8594
780 4JT 0.8594
781 4NC 0.8589
782 M4N 0.8587
783 B60 0.8586
784 8SK 0.8586
785 4HC 0.8583
786 BVA 0.8583
787 MAQ 0.8582
788 DFL 0.8580
789 DBS 0.8577
790 GB5 0.8577
791 3GX 0.8577
792 3HM 0.8576
793 AVX 0.8575
794 AZ8 0.8573
795 75K 0.8573
796 ZEA 0.8571
797 9OF 0.8570
798 25F 0.8570
799 B57 0.8568
800 PYQ 0.8567
801 ST1 0.8566
802 FGZ 0.8566
803 PE0 0.8566
804 B23 0.8563
805 64C 0.8561
806 MYJ 0.8559
807 ES7 0.8558
808 ABV 0.8556
809 ISN 0.8554
810 A6P 0.8552
811 K22 0.8552
812 M83 0.8550
813 D2G 0.8548
814 NPA 0.8544
815 55D 0.8544
816 1X8 0.8544
817 3DT 0.8543
818 5JQ 0.8537
819 3XR 0.8537
820 VK3 0.8534
821 5WN 0.8532
822 6BL 0.8528
823 8XQ 0.8527
824 B4O 0.8525
825 AX7 0.8522
826 FDB 0.8519
827 SXS 0.8510
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5F1H; Ligand: 5U6; Similar sites found with APoc: 4
This union binding pocket(no: 1) in the query (biounit: 5f1h.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
1 6J3P B8O 34.9594
2 6J3O B4L 35
3 6J3O B4L 35
4 5TPX 7H7 35.7724
Pocket No.: 2; Query (leader) PDB : 5F1H; Ligand: 5U6; Similar sites found with APoc: 9
This union binding pocket(no: 2) in the query (biounit: 5f1h.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 6J3P B8O 34.9594
2 6J3P B8O 34.9594
3 6J3O B4L 35
4 5TPX 7H7 35.7724
5 5MLJ 9ST 38.3929
6 5MLJ 9ST 38.3929
7 5ML0 P2L 39.0909
8 5FDZ 5X0 41.1765
9 5FDZ 5X0 41.1765
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