Receptor
PDB id Resolution Class Description Source Keywords
5MZJ 2 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF STABILIZED A2A ADENOSINE RECEPTOR A2AR- IN COMPLEX WITH THEOPHYLLINE AT 2.0A RESOLUTION HOMO SAPIENS, ESCHERICHIA COLI G-PROTEIN-COUPLED RECEPTOR INTEGRAL THERMOSTABILIZING MUTATMEMBRANE PROTEIN
Ref.: STRUCTURES OF HUMAN A1 AND A2A ADENOSINE RECEPTORS XANTHINES REVEAL DETERMINANTS OF SELECTIVITY. STRUCTURE V. 25 1275 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
OLA A:2422;
A:2426;
A:2420;
A:2415;
A:2412;
A:2406;
A:2409;
A:2413;
A:2410;
A:2405;
A:2416;
A:2408;
A:2419;
A:2417;
A:2425;
A:2418;
A:2424;
A:2421;
A:2411;
A:2414;
A:2407;
A:2423;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
282.461 C18 H34 O2 CCCCC...
OLC A:2429;
A:2428;
A:2427;
A:2432;
A:2431;
A:2430;
A:2433;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
submit data
356.54 C21 H40 O4 CCCCC...
CLR A:2403;
A:2402;
A:2404;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
386.654 C27 H46 O CC(C)...
NA A:2400;
Part of Protein;
none;
submit data
22.99 Na [Na+]
TEP A:2401;
Valid;
none;
submit data
180.164 C7 H8 N4 O2 CN1c2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5OLZ 1.9 Å NON-ENZYME: SIGNAL_HORMONE STRUCTURE OF THE A2A-STAR2-BRIL562-COMPOUND 4E COMPLEX AT 1. OBTAINED FROM BESPOKE CO-CRYSTALLISATION EXPERIMENTS. HOMO SAPIENS, ESCHERICHIA COLI G-PROTEIN COUPLED RECEPTOR ADENOSINE 2A RECEPTOR 7 TM INTEMEMBRANE PROTEIN THERMOSTABILIZING MUTATIONS MEMBRANE PRO
Ref.: TOWARDS HIGH THROUGHPUT GPCR CRYSTALLOGRAPHY: IN ME SOAKING OF ADENOSINE A2A RECEPTOR CRYSTALS. SCI REP V. 8 41 2018
Members (25)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 5IU7 Ki = 1.1 nM 6DY C21 H24 N8 O c1ccc(cc1)....
2 6ZDV - QGW C19 H19 N O4 S CCCc1cc2c(....
3 5K2C - ZMA C16 H15 N7 O2 c1cc(oc1)c....
4 4EIY - ZMA C16 H15 N7 O2 c1cc(oc1)c....
5 6JZH - ZMA C16 H15 N7 O2 c1cc(oc1)c....
6 6LPJ - ZMA C16 H15 N7 O2 c1cc(oc1)c....
7 5K2B - ZMA C16 H15 N7 O2 c1cc(oc1)c....
8 5IUA Ki = 1.5 nM 6DX C21 H25 N9 O c1ccc(cc1)....
9 6LPK - ZMA C16 H15 N7 O2 c1cc(oc1)c....
10 5OLV Kd = 320 nM 9Y2 C16 H17 F2 N3 O2 S CC(C)(C)CC....
11 5IU4 Ki = 0.53 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
12 6PS7 - ZMA C16 H15 N7 O2 c1cc(oc1)c....
13 6LPL - ZMA C16 H15 N7 O2 c1cc(oc1)c....
14 5OM1 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
15 5IUB Ki = 0.35 nM 6DV C20 H21 F2 N9 O c1cc(oc1)c....
16 6ZDR - QGE C18 H17 N O4 S CCCc1cc2c(....
17 5K2D - ZMA C16 H15 N7 O2 c1cc(oc1)c....
18 5VRA - ZMA C16 H15 N7 O2 c1cc(oc1)c....
19 5OM4 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
20 5IU8 Ki = 18 nM 6DZ C15 H21 N9 O CN1CCN(CC1....
21 5MZP - CFF C8 H10 N4 O2 Cn1cnc2c1C....
22 5MZJ - TEP C7 H8 N4 O2 CN1c2c([nH....
23 5OLG Kd = 2.5 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
24 5K2A - ZMA C16 H15 N7 O2 c1cc(oc1)c....
25 5OLZ Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
70% Homology Family (25)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 5IU7 Ki = 1.1 nM 6DY C21 H24 N8 O c1ccc(cc1)....
2 6ZDV - QGW C19 H19 N O4 S CCCc1cc2c(....
3 5K2C - ZMA C16 H15 N7 O2 c1cc(oc1)c....
4 4EIY - ZMA C16 H15 N7 O2 c1cc(oc1)c....
5 6JZH - ZMA C16 H15 N7 O2 c1cc(oc1)c....
6 6LPJ - ZMA C16 H15 N7 O2 c1cc(oc1)c....
7 5K2B - ZMA C16 H15 N7 O2 c1cc(oc1)c....
8 5IUA Ki = 1.5 nM 6DX C21 H25 N9 O c1ccc(cc1)....
9 6LPK - ZMA C16 H15 N7 O2 c1cc(oc1)c....
10 5OLV Kd = 320 nM 9Y2 C16 H17 F2 N3 O2 S CC(C)(C)CC....
11 5IU4 Ki = 0.53 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
12 6PS7 - ZMA C16 H15 N7 O2 c1cc(oc1)c....
13 6LPL - ZMA C16 H15 N7 O2 c1cc(oc1)c....
14 5OM1 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
15 5IUB Ki = 0.35 nM 6DV C20 H21 F2 N9 O c1cc(oc1)c....
16 6ZDR - QGE C18 H17 N O4 S CCCc1cc2c(....
17 5K2D - ZMA C16 H15 N7 O2 c1cc(oc1)c....
18 5VRA - ZMA C16 H15 N7 O2 c1cc(oc1)c....
19 5OM4 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
20 5IU8 Ki = 18 nM 6DZ C15 H21 N9 O CN1CCN(CC1....
21 5MZP - CFF C8 H10 N4 O2 Cn1cnc2c1C....
22 5MZJ - TEP C7 H8 N4 O2 CN1c2c([nH....
23 5OLG Kd = 2.5 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
24 5K2A - ZMA C16 H15 N7 O2 c1cc(oc1)c....
25 5OLZ Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
50% Homology Family (32)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 5WIU - AQD C21 H26 Cl N3 O2 C[C@@H]1[C....
2 5WIV - AQD C21 H26 Cl N3 O2 C[C@@H]1[C....
3 5IU7 Ki = 1.1 nM 6DY C21 H24 N8 O c1ccc(cc1)....
4 6ZDV - QGW C19 H19 N O4 S CCCc1cc2c(....
5 5K2C - ZMA C16 H15 N7 O2 c1cc(oc1)c....
6 4EIY - ZMA C16 H15 N7 O2 c1cc(oc1)c....
7 6JZH - ZMA C16 H15 N7 O2 c1cc(oc1)c....
8 6LPJ - ZMA C16 H15 N7 O2 c1cc(oc1)c....
9 5K2B - ZMA C16 H15 N7 O2 c1cc(oc1)c....
10 5IUA Ki = 1.5 nM 6DX C21 H25 N9 O c1ccc(cc1)....
11 6LPK - ZMA C16 H15 N7 O2 c1cc(oc1)c....
12 5OLV Kd = 320 nM 9Y2 C16 H17 F2 N3 O2 S CC(C)(C)CC....
13 5IU4 Ki = 0.53 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
14 6PS7 - ZMA C16 H15 N7 O2 c1cc(oc1)c....
15 6LPL - ZMA C16 H15 N7 O2 c1cc(oc1)c....
16 5OM1 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
17 5IUB Ki = 0.35 nM 6DV C20 H21 F2 N9 O c1cc(oc1)c....
18 6ZDR - QGE C18 H17 N O4 S CCCc1cc2c(....
19 5K2D - ZMA C16 H15 N7 O2 c1cc(oc1)c....
20 5VRA - ZMA C16 H15 N7 O2 c1cc(oc1)c....
21 5OM4 Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
22 5IU8 Ki = 18 nM 6DZ C15 H21 N9 O CN1CCN(CC1....
23 5MZP - CFF C8 H10 N4 O2 Cn1cnc2c1C....
24 5MZJ - TEP C7 H8 N4 O2 CN1c2c([nH....
25 5OLG Kd = 2.5 nM ZMA C16 H15 N7 O2 c1cc(oc1)c....
26 5K2A - ZMA C16 H15 N7 O2 c1cc(oc1)c....
27 5OLZ Kd = 250 pM T4E C15 H11 Cl N4 O c1ccc(cc1)....
28 4PXZ - 6AD C11 H17 N5 O10 P2 S CSc1nc(c2c....
29 5ZKC Kd = 6.4 nM 3C0 C18 H24 N O4 C[N+]1([C@....
30 5YC8 Kd = 6.4 nM 3C0 C18 H24 N O4 C[N+]1([C@....
31 6RZ7 - KNW C30 H30 Cl F N2 O7 c1cc(c2c(c....
32 6RZ6 - KNW C30 H30 Cl F N2 O7 c1cc(c2c(c....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: TEP; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 TEP 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: TEP; Similar ligands found: 986
No: Ligand Similarity coefficient
1 G3F 0.9930
2 BGC 0.9876
3 8S0 0.9853
4 9KT 0.9846
5 MT5 0.9819
6 RPQ 0.9816
7 CFF 0.9810
8 ISE 0.9806
9 NTZ 0.9798
10 PFB 0.9795
11 GIM 0.9792
12 LI6 0.9787
13 TBS 0.9765
14 209 0.9759
15 GCS 0.9748
16 H33 0.9729
17 K17 0.9716
18 GLC 0.9712
19 AEZ 0.9707
20 LGC 0.9706
21 B57 0.9676
22 NQ 0.9674
23 VK3 0.9669
24 PHH 0.9666
25 HTP 0.9659
26 SHG 0.9650
27 BDP 0.9648
28 TTL 0.9641
29 INS 0.9639
30 KBG 0.9638
31 NDM 0.9637
32 RXA 0.9629
33 AZ9 0.9619
34 MVL 0.9606
35 DPZ 0.9604
36 680 0.9601
37 HFB 0.9594
38 3MG 0.9594
39 PYQ 0.9593
40 HQD 0.9586
41 3WA 0.9586
42 JBQ 0.9584
43 HHA 0.9583
44 NOJ 0.9583
45 12B 0.9581
46 ADK 0.9570
47 15L 0.9569
48 CTS 0.9568
49 GAL 0.9563
50 3F0 0.9563
51 JUG 0.9551
52 GIO 0.9549
53 GCU 0.9546
54 0N7 0.9540
55 HJP 0.9538
56 G5V 0.9536
57 GRE 0.9535
58 GUN 0.9527
59 B60 0.9524
60 3HA 0.9524
61 6F0 0.9523
62 BCF 0.9519
63 PCI 0.9518
64 2ZV 0.9517
65 G1O 0.9514
66 7NI 0.9514
67 ZVO 0.9513
68 XAN 0.9512
69 4AA 0.9511
70 K32 0.9510
71 X05 0.9507
72 DQN 0.9504
73 BBF 0.9498
74 K8X 0.9496
75 BSP 0.9496
76 Q6T 0.9495
77 6M1 0.9491
78 AZA 0.9487
79 FOT 0.9486
80 25W 0.9485
81 IBF 0.9481
82 BEA 0.9479
83 HNQ 0.9479
84 LCN 0.9472
85 9DG 0.9471
86 G2F 0.9471
87 39A 0.9466
88 AKH 0.9462
89 MT0 0.9461
90 KJH 0.9460
91 12Q 0.9460
92 M1A 0.9458
93 UEG 0.9458
94 DBH 0.9455
95 67N 0.9455
96 3M0 0.9455
97 MAQ 0.9454
98 2ZQ 0.9453
99 HZQ 0.9452
100 FE DB1 0.9451
101 5QX 0.9444
102 94B 0.9443
103 AZ8 0.9443
104 KJY 0.9442
105 G6D 0.9442
106 ASO 0.9441
107 6AP 0.9440
108 37T 0.9440
109 FDB 0.9440
110 7W1 0.9439
111 5WY 0.9436
112 PE0 0.9432
113 K6X 0.9432
114 7ZE 0.9431
115 141 0.9431
116 HQT 0.9430
117 A2F 0.9430
118 QX2 0.9429
119 F3B 0.9428
120 QWW 0.9427
121 IGA 0.9427
122 8XQ 0.9427
123 R8V 0.9423
124 PXL 0.9421
125 CLZ 0.9420
126 Q24 0.9417
127 AZG 0.9415
128 NOY 0.9414
129 CFP 0.9411
130 IFL 0.9411
131 EA1 0.9405
132 K22 0.9405
133 M5K 0.9404
134 GCB 0.9404
135 YH7 0.9401
136 495 0.9400
137 JBK 0.9400
138 HLZ 0.9400
139 UNC 0.9396
140 1XM 0.9395
141 MAN 0.9393
142 NID 0.9391
143 0P6 0.9391
144 DMD 0.9388
145 XYP 0.9388
146 URC 0.9387
147 TOF 0.9386
148 3ID 0.9383
149 INE 0.9381
150 TTY 0.9379
151 42C 0.9378
152 32X 0.9378
153 AQO 0.9375
154 290 0.9374
155 MEW 0.9374
156 IJZ 0.9370
157 DX4 0.9370
158 4HC 0.9370
159 3PF 0.9368
160 82I 0.9367
161 LKA 0.9365
162 N5J 0.9364
163 0CU 0.9364
164 J9W 0.9363
165 APZ 0.9361
166 948 0.9360
167 1NP 0.9360
168 3IT 0.9360
169 2H5 0.9358
170 F5B 0.9356
171 HQY 0.9355
172 VNL 0.9355
173 AJ2 0.9351
174 B53 0.9349
175 LXC 0.9349
176 5Q0 0.9347
177 SKA 0.9346
178 EVA 0.9346
179 AFR 0.9346
180 5SG 0.9344
181 O72 0.9344
182 C2U 0.9343
183 4YS 0.9342
184 1SQ 0.9342
185 1LM 0.9340
186 9MG 0.9339
187 6GU 0.9338
188 BOA 0.9335
189 SYA 0.9335
190 ES1 0.9335
191 A7W 0.9335
192 BTY 0.9334
193 PRF 0.9331
194 24W 0.9330
195 3MA 0.9330
196 8CM 0.9330
197 1LQ 0.9329
198 7VJ 0.9327
199 EQT 0.9325
200 K3Q 0.9324
201 PQ0 0.9323
202 OA3 0.9323
203 7B3 0.9323
204 PXM 0.9320
205 G3E 0.9320
206 JPZ 0.9318
207 5IQ 0.9316
208 QWN 0.9312
209 GCV 0.9311
210 75K 0.9303
211 PX7 0.9300
212 GLA 0.9298
213 JBH 0.9298
214 FLV 0.9294
215 5WX 0.9294
216 Q88 0.9293
217 HH5 0.9291
218 IV2 0.9289
219 18N 0.9287
220 3FH 0.9285
221 XAZ 0.9281
222 5JQ 0.9278
223 DIU 0.9276
224 23A 0.9276
225 PA1 0.9276
226 ES0 0.9273
227 2FQ 0.9271
228 X09 0.9269
229 5QY 0.9268
230 HPA 0.9266
231 ALL 0.9266
232 UQ 0.9266
233 CWS 0.9265
234 FH2 0.9263
235 DHQ 0.9261
236 226 0.9260
237 BMA 0.9260
238 M1Q 0.9260
239 GOG 0.9258
240 4ME 0.9257
241 329 0.9256
242 GCW 0.9256
243 FBT 0.9256
244 7VS 0.9255
245 X8D 0.9255
246 ADZ 0.9255
247 BNT 0.9255
248 7B4 0.9254
249 06B 0.9253
250 MUA 0.9252
251 SOE 0.9252
252 GLF 0.9250
253 QBK 0.9249
254 ADE 0.9249
255 B55 0.9249
256 DIN 0.9246
257 EXO 0.9243
258 SAL 0.9243
259 SE2 0.9242
260 HH8 0.9241
261 FDK 0.9237
262 GTZ 0.9236
263 BTE 0.9235
264 D48 0.9232
265 3RK 0.9232
266 7HP 0.9229
267 6BL 0.9228
268 DHK 0.9227
269 QPR 0.9226
270 KT7 0.9226
271 10L 0.9224
272 DBJ 0.9224
273 KUF 0.9222
274 5M0 0.9222
275 BCP 0.9220
276 BE2 0.9218
277 QXW 0.9218
278 KIB 0.9215
279 KIA 0.9215
280 4XH 0.9214
281 YSO 0.9213
282 5NU 0.9211
283 M0Q 0.9211
284 8TX 0.9210
285 IFM 0.9210
286 FBG 0.9205
287 5WV 0.9205
288 XXR 0.9205
289 KIF 0.9201
290 7W4 0.9200
291 CWM 0.9199
292 SJ5 0.9198
293 M6N 0.9197
294 7WA 0.9197
295 DMJ 0.9195
296 XHP 0.9194
297 EJZ 0.9192
298 5CU 0.9191
299 MIG 0.9191
300 149 0.9191
301 MO8 0.9189
302 Z5P 0.9186
303 L7T 0.9186
304 ZWZ 0.9186
305 GOX 0.9184
306 ISN 0.9183
307 ZB1 0.9183
308 9DA 0.9183
309 8IG 0.9182
310 UAN 0.9182
311 BP1 0.9181
312 9HX 0.9181
313 2AK 0.9180
314 5RO 0.9180
315 J5I 0.9179
316 KYD 0.9177
317 KGK 0.9176
318 2D0 0.9173
319 1GN 0.9173
320 X6X 0.9173
321 3U4 0.9171
322 1WD 0.9170
323 5RG 0.9169
324 44V 0.9169
325 7HQ 0.9168
326 GLT 0.9168
327 XQ0 0.9167
328 FA0 0.9165
329 F12 0.9164
330 KFH 0.9164
331 MRW 0.9163
332 5JL 0.9161
333 9PY 0.9160
334 KKN 0.9159
335 LT2 0.9159
336 AHR 0.9158
337 1XN 0.9158
338 4M0 0.9158
339 DOB 0.9158
340 JTH 0.9157
341 BHA 0.9156
342 GTR 0.9156
343 WOO 0.9155
344 SOR 0.9155
345 OTW 0.9153
346 GIV 0.9152
347 6MP 0.9152
348 ES6 0.9152
349 DRL 0.9149
350 ADA 0.9146
351 M0W 0.9144
352 K5W 0.9144
353 PM6 0.9143
354 4SV 0.9143
355 I1N 0.9142
356 P3K 0.9141
357 44W 0.9137
358 2KA 0.9137
359 SWA 0.9136
360 0W8 0.9136
361 92K 0.9136
362 ICO 0.9136
363 3Z8 0.9135
364 XXP 0.9135
365 GTQ 0.9130
366 5RN 0.9130
367 I3A 0.9127
368 GDE 0.9125
369 6CS 0.9125
370 JKE 0.9125
371 ES7 0.9123
372 F81 0.9121
373 B62 0.9121
374 OXZ 0.9121
375 BZX 0.9121
376 DFB 0.9119
377 GAF 0.9118
378 6RQ 0.9117
379 2EC 0.9117
380 F1A 0.9116
381 DQU 0.9115
382 D07 0.9114
383 SYV 0.9111
384 ES4 0.9110
385 3RI 0.9109
386 AJV 0.9108
387 QX4 0.9106
388 SVN 0.9103
389 NDH 0.9102
390 FUL 0.9101
391 N8Y 0.9100
392 SWD 0.9099
393 COU 0.9098
394 GSY 0.9096
395 1U6 0.9092
396 DNF 0.9092
397 M1E 0.9091
398 NPY 0.9089
399 2FG 0.9088
400 JU2 0.9088
401 7WV 0.9088
402 2AQ 0.9087
403 JBE 0.9087
404 ASC 0.9086
405 DHB 0.9086
406 E7Z 0.9085
407 6AI 0.9084
408 4MU 0.9084
409 9TZ 0.9083
410 GYE 0.9083
411 2K4 0.9080
412 GXL 0.9078
413 0FN 0.9077
414 JKZ 0.9076
415 MBG 0.9076
416 PEY 0.9075
417 CTL 0.9075
418 54G 0.9073
419 6VD 0.9068
420 ES5 0.9067
421 QUZ 0.9067
422 4FS 0.9065
423 6ME 0.9064
424 M1H 0.9064
425 OCH 0.9064
426 F60 0.9062
427 7D2 0.9058
428 INO 0.9057
429 ZYR 0.9056
430 MZB 0.9054
431 PHT 0.9053
432 4NC 0.9053
433 03V 0.9052
434 JIF 0.9052
435 5MB 0.9051
436 NGO 0.9049
437 MNM 0.9049
438 H42 0.9049
439 NTM 0.9047
440 3DM 0.9047
441 ET2 0.9045
442 XYS 0.9043
443 MVN 0.9042
444 14O 0.9042
445 5H1 0.9040
446 270 0.9039
447 0FO 0.9039
448 4AN 0.9039
449 5MK 0.9039
450 5CL 0.9037
451 7WR 0.9036
452 SRO 0.9035
453 GJS 0.9033
454 JB5 0.9033
455 K37 0.9032
456 ZZ8 0.9030
457 5MI 0.9030
458 HKD 0.9030
459 5WU 0.9027
460 1X7 0.9026
461 GM7 0.9024
462 AIN 0.9023
463 XQG 0.9022
464 PBR 0.9021
465 9EW 0.9021
466 8GC 0.9021
467 86J 0.9019
468 0RW 0.9019
469 SVD 0.9018
470 F0J 0.9017
471 F05 0.9015
472 DNC 0.9014
473 ES9 0.9014
474 BDF 0.9011
475 JXN 0.9011
476 CN0 0.9010
477 NNO 0.9010
478 CLW 0.9010
479 H5B 0.9009
480 J9Q 0.9006
481 LYL 0.9005
482 4A3 0.9005
483 1P8 0.9004
484 YQA 0.9003
485 3DO 0.9002
486 6M9 0.9001
487 293 0.9001
488 FYU 0.9000
489 93K 0.8999
490 GV9 0.8997
491 9FL 0.8997
492 5OB 0.8996
493 97T 0.8995
494 YIO 0.8995
495 HA7 0.8994
496 SX1 0.8992
497 3HM 0.8992
498 AX7 0.8992
499 HXX 0.8991
500 FK1 0.8991
501 XX2 0.8991
502 Q7A 0.8990
503 UFO 0.8989
504 6M4 0.8988
505 D3M 0.8985
506 DGJ 0.8985
507 DIE 0.8983
508 1P7 0.8983
509 3GQ 0.8983
510 MYJ 0.8982
511 M2K 0.8982
512 ORO 0.8981
513 RAM 0.8978
514 GZL 0.8977
515 1WG 0.8976
516 SHA 0.8974
517 11S 0.8974
518 4Z4 0.8972
519 FUF 0.8966
520 AMG 0.8966
521 OXC 0.8965
522 QSH 0.8965
523 MS9 0.8964
524 GT0 0.8964
525 36R 0.8961
526 G12 0.8960
527 KJU 0.8960
528 4XR 0.8960
529 RNS 0.8959
530 NGT 0.8959
531 SXS 0.8958
532 4TU 0.8957
533 HLR 0.8956
534 MT8 0.8955
535 V55 0.8954
536 H6B 0.8954
537 ES2 0.8952
538 2CK 0.8951
539 5HN 0.8951
540 VGD 0.8950
541 3AB 0.8949
542 P9P 0.8949
543 GOO 0.8947
544 GXY 0.8945
545 4HM 0.8945
546 AZF 0.8945
547 2LY 0.8944
548 2MN 0.8943
549 5GU 0.8943
550 RM1 0.8942
551 LSA 0.8941
552 SKM 0.8939
553 HIS 0.8939
554 2CQ 0.8938
555 7ME 0.8937
556 MFU 0.8937
557 KLW 0.8937
558 H4N 0.8936
559 FHB 0.8935
560 HMU 0.8935
561 4RU 0.8935
562 1DW 0.8934
563 5NE 0.8934
564 QAT 0.8933
565 L3Q 0.8931
566 39O 0.8930
567 2D3 0.8930
568 42A 0.8930
569 2HO 0.8928
570 JAE 0.8928
571 I6G 0.8928
572 VNJ 0.8926
573 92P 0.8922
574 FDR 0.8921
575 4JT 0.8921
576 BZ3 0.8920
577 2HQ 0.8920
578 4KL 0.8920
579 LDR 0.8920
580 FGZ 0.8919
581 FHN 0.8919
582 2FY 0.8919
583 5B1 0.8918
584 GZ8 0.8917
585 B0D 0.8917
586 15E 0.8917
587 DOR 0.8915
588 C2Y 0.8915
589 JFD 0.8914
590 LZM 0.8913
591 8HC 0.8910
592 EYK 0.8910
593 EMZ 0.8909
594 JLZ 0.8908
595 3XX 0.8905
596 PDC 0.8905
597 ZXD 0.8905
598 F31 0.8902
599 PYG 0.8901
600 MMA 0.8900
601 MHK 0.8898
602 3HB 0.8897
603 REL 0.8897
604 GTL 0.8897
605 1HN 0.8896
606 7MH 0.8896
607 GJP 0.8895
608 O2A 0.8895
609 PQK 0.8895
610 FB1 0.8894
611 GAB 0.8893
612 4XV 0.8893
613 8NY 0.8891
614 SRT 0.8891
615 NMJ 0.8891
616 28N 0.8891
617 150 0.8890
618 BK9 0.8890
619 9AP 0.8890
620 1KP 0.8889
621 64K 0.8889
622 QAS 0.8889
623 8W9 0.8887
624 G4D 0.8887
625 3NT 0.8887
626 FBB 0.8887
627 9TW 0.8886
628 IPB 0.8886
629 TFU 0.8885
630 0MK 0.8884
631 DNA 0.8884
632 3OC 0.8883
633 XQK 0.8882
634 RHU 0.8881
635 3C1 0.8880
636 FUC 0.8880
637 2MI 0.8880
638 5VM 0.8880
639 MXX 0.8880
640 S76 0.8880
641 QSB 0.8877
642 4M4 0.8876
643 CHB 0.8873
644 E7R 0.8871
645 VOH 0.8871
646 RM4 0.8871
647 D1X 0.8871
648 4CS 0.8870
649 HMH 0.8870
650 BPU 0.8870
651 5XC 0.8869
652 52C 0.8869
653 3C2 0.8868
654 34D 0.8867
655 FA3 0.8867
656 IBM 0.8867
657 ODO 0.8866
658 8WT 0.8865
659 IFP 0.8865
660 JG8 0.8861
661 EUG 0.8860
662 PRZ 0.8857
663 BZF 0.8855
664 FLC 0.8854
665 AA 0.8853
666 6LW 0.8853
667 MQN 0.8852
668 537 0.8850
669 AW5 0.8849
670 BZI 0.8849
671 JZ9 0.8848
672 TWO 0.8847
673 5NS 0.8846
674 ABV 0.8845
675 MFB 0.8845
676 OVV 0.8844
677 TIY 0.8843
678 4JQ 0.8843
679 DEN 0.8840
680 EKZ 0.8840
681 9CA 0.8838
682 582 0.8838
683 P92 0.8837
684 XM0 0.8837
685 2AL 0.8837
686 URF 0.8836
687 N3W 0.8836
688 FCA 0.8836
689 6XI 0.8835
690 45C 0.8835
691 TH7 0.8834
692 4XS 0.8832
693 IND 0.8830
694 4JP 0.8829
695 3Z7 0.8828
696 ZZZ 0.8826
697 MR1 0.8826
698 0R1 0.8824
699 0CT 0.8824
700 FBV 0.8824
701 0F9 0.8824
702 K2T 0.8821
703 KP6 0.8820
704 ENL 0.8820
705 GVH 0.8818
706 12M 0.8818
707 2CL 0.8817
708 8WO 0.8817
709 3FA 0.8815
710 FCB 0.8815
711 MPI 0.8815
712 NAG 0.8813
713 KJ5 0.8812
714 0FK 0.8811
715 WBU 0.8810
716 MM2 0.8810
717 FP1 0.8809
718 0HO 0.8809
719 LZ1 0.8807
720 ARB 0.8807
721 TDR 0.8804
722 4YO 0.8803
723 IF7 0.8803
724 MBD 0.8803
725 DEE 0.8801
726 OVM 0.8800
727 LT8 0.8800
728 ZZT 0.8800
729 A13 0.8800
730 JXW 0.8799
731 PH2 0.8798
732 X0V 0.8797
733 3SK 0.8797
734 3MB 0.8795
735 0JD 0.8795
736 Q77 0.8793
737 DBX 0.8792
738 35C 0.8791
739 4FH 0.8790
740 R8A 0.8790
741 IHB 0.8789
742 RSF 0.8789
743 1PT 0.8788
744 WCE 0.8786
745 KOJ 0.8784
746 T6C 0.8784
747 1IT 0.8783
748 0TU 0.8781
749 3BZ 0.8777
750 AJY 0.8777
751 QIC 0.8777
752 2GS 0.8777
753 II6 0.8776
754 MWP 0.8775
755 NK 0.8775
756 GMN 0.8774
757 HHR 0.8772
758 RIP 0.8771
759 E1K 0.8771
760 JZ3 0.8770
761 Q71 0.8767
762 RIB 0.8767
763 GBD 0.8767
764 M3S 0.8766
765 NVU 0.8765
766 FA1 0.8761
767 6NT 0.8761
768 ANF 0.8760
769 MWM 0.8759
770 F9Y 0.8759
771 LZ2 0.8759
772 3NY 0.8757
773 2C9 0.8757
774 NCA 0.8757
775 IDM 0.8755
776 DFU 0.8755
777 51R 0.8754
778 KBB 0.8754
779 N2I 0.8754
780 NPO 0.8753
781 MSN 0.8753
782 60P 0.8752
783 TH0 0.8751
784 0TR 0.8751
785 BHO 0.8751
786 1U1 0.8751
787 4PW 0.8750
788 4HO 0.8749
789 20J 0.8749
790 8ZE 0.8748
791 53C 0.8747
792 XBZ 0.8746
793 4ZE 0.8744
794 ARA 0.8742
795 CIP 0.8741
796 261 0.8740
797 BEN 0.8740
798 ONR 0.8739
799 BRT 0.8739
800 3MC 0.8738
801 FFP 0.8737
802 JYB 0.8735
803 FLM 0.8734
804 2MY 0.8734
805 GCO 0.8734
806 BAM 0.8734
807 5UC 0.8733
808 MM1 0.8732
809 27B 0.8732
810 SFU 0.8732
811 0HN 0.8730
812 E3D 0.8730
813 F4Z 0.8730
814 IPZ 0.8730
815 39U 0.8729
816 L99 0.8729
817 FRU 0.8726
818 2CM 0.8724
819 TC7 0.8724
820 8GK 0.8724
821 CWJ 0.8723
822 JA8 0.8721
823 1MC 0.8721
824 7MK 0.8718
825 173 0.8717
826 HLD 0.8717
827 2ZM 0.8715
828 HX3 0.8715
829 24B 0.8715
830 HBD 0.8715
831 3R6 0.8714
832 B5D 0.8714
833 64C 0.8713
834 UFV 0.8713
835 SF9 0.8711
836 9LI 0.8711
837 AY4 0.8711
838 GF4 0.8710
839 FSW 0.8710
840 2A9 0.8709
841 PHE 0.8708
842 275 0.8708
843 W81 0.8707
844 3CE 0.8706
845 MCT 0.8705
846 KYA 0.8705
847 ARW 0.8704
848 67X 0.8703
849 43M 0.8702
850 OXQ 0.8701
851 1Y6 0.8701
852 JR2 0.8700
853 DX3 0.8699
854 BEZ 0.8696
855 6MH 0.8696
856 DQA 0.8696
857 E7S 0.8692
858 6KX 0.8691
859 BA5 0.8691
860 8MO 0.8691
861 NDG 0.8689
862 23J 0.8689
863 JXZ 0.8688
864 PZA 0.8687
865 4ZC 0.8687
866 CGB 0.8686
867 THA 0.8685
868 GAG 0.8683
869 TM4 0.8683
870 XYD 0.8682
871 H62 0.8681
872 15N 0.8680
873 C9E 0.8679
874 VXX 0.8678
875 1P3 0.8676
876 DUB 0.8676
877 3MH 0.8675
878 ICP 0.8675
879 TGX 0.8674
880 2HU 0.8674
881 G1P 0.8672
882 0R0 0.8671
883 7CZ 0.8671
884 4P5 0.8670
885 8H8 0.8669
886 2AC 0.8669
887 KDV 0.8669
888 YCP 0.8668
889 N7P 0.8667
890 2YU 0.8666
891 6PC 0.8665
892 PHB 0.8661
893 XIY 0.8660
894 34A 0.8660
895 6NI 0.8660
896 2MP 0.8659
897 57O 0.8659
898 3TJ 0.8656
899 UNU 0.8656
900 PJW 0.8655
901 5NI 0.8653
902 OW4 0.8653
903 A1U 0.8653
904 QOS 0.8650
905 4JO 0.8650
906 J9T 0.8650
907 R8S 0.8648
908 ABI 0.8646
909 6R8 0.8646
910 30G 0.8642
911 4SX 0.8641
912 3A9 0.8640
913 286 0.8640
914 9R5 0.8639
915 NTN 0.8638
916 1M2 0.8635
917 1F1 0.8632
918 PYD 0.8632
919 GNM 0.8631
920 HQJ 0.8630
921 5MH 0.8630
922 GIF 0.8629
923 IP0 0.8628
924 NSP 0.8627
925 XM5 0.8627
926 PFL 0.8625
927 BRV 0.8625
928 N8P 0.8624
929 E1T 0.8622
930 3QV 0.8622
931 NBZ 0.8622
932 HT4 0.8620
933 X0W 0.8620
934 M4E 0.8618
935 TIU 0.8618
936 NIZ 0.8614
937 BZJ 0.8611
938 MZG 0.8611
939 JND 0.8610
940 94W 0.8607
941 0XT 0.8606
942 ROI 0.8604
943 PAF 0.8604
944 JZ2 0.8603
945 FPY 0.8602
946 P72 0.8601
947 PAB 0.8596
948 TBP 0.8596
949 091 0.8594
950 826 0.8594
951 QM1 0.8593
952 TSS 0.8593
953 2F6 0.8592
954 FA6 0.8592
955 BR8 0.8591
956 PBZ 0.8591
957 LDP 0.8591
958 TM7 0.8590
959 4MA 0.8587
960 PD2 0.8584
961 4CL 0.8584
962 5VJ 0.8580
963 NIO 0.8580
964 M5N 0.8578
965 ZZ3 0.8577
966 9KH 0.8575
967 5JC 0.8575
968 AN3 0.8574
969 4JJ 0.8571
970 IUP 0.8565
971 FUD 0.8561
972 NLA 0.8561
973 JAW 0.8560
974 1XA 0.8560
975 7MU 0.8557
976 IDH 0.8556
977 IUR 0.8553
978 ARP 0.8543
979 NEQ 0.8543
980 7MX 0.8540
981 BPY 0.8538
982 FBW 0.8522
983 LAO 0.8521
984 4VS 0.8520
985 FBU 0.8520
986 BR9 0.8517
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5OLZ; Ligand: T4E; 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: 5olz.bio1) has 41 residues
No: Leader PDB Ligand Sequence Similarity
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