Receptor
PDB id Resolution Class Description Source Keywords
4FCW 2.35 Å NON-ENZYME: FOLDING CRYSTAL STRUCTURE OF THE C-TERMINAL DOMAIN OF CLPB THERMUS THERMOPHILUS AAA DOMAIN CHAPERONE
Ref.: STRUCTURAL BASIS FOR INTERSUBUNIT SIGNALING IN A PR DISAGGREGATING MACHINE. PROC.NATL.ACAD.SCI.USA V. 109 12515 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:901;
C:901;
F:901;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4FCW 2.35 Å NON-ENZYME: FOLDING CRYSTAL STRUCTURE OF THE C-TERMINAL DOMAIN OF CLPB THERMUS THERMOPHILUS AAA DOMAIN CHAPERONE
Ref.: STRUCTURAL BASIS FOR INTERSUBUNIT SIGNALING IN A PR DISAGGREGATING MACHINE. PROC.NATL.ACAD.SCI.USA V. 109 12515 2012
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 4FCW - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 18 families.
1 4FCW - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 13 families.
1 4FCW - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP; Similar ligands found: 435
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 ATP 0.9 1
3 A2D 0.895522 0.971831
4 AQP 0.887324 1
5 5FA 0.887324 1
6 AP5 0.884058 0.971831
7 B4P 0.884058 0.971831
8 BA3 0.869565 0.971831
9 AN2 0.84507 0.985915
10 M33 0.833333 0.958333
11 ACQ 0.826667 0.972222
12 A 0.823529 0.971429
13 AMP 0.823529 0.971429
14 ACP 0.821918 0.972222
15 AR6 0.810811 0.971831
16 APR 0.810811 0.971831
17 ANP 0.802632 0.972222
18 AD9 0.8 0.972222
19 AGS 0.8 0.945946
20 SAP 0.8 0.945946
21 ADX 0.783784 0.873418
22 CA0 0.783784 0.945205
23 TAT 0.779221 0.958904
24 AMP MG 0.774648 0.891892
25 50T 0.773333 0.958333
26 ABM 0.763889 0.917808
27 APC 0.763158 0.958904
28 PRX 0.763158 0.893333
29 ATF 0.759494 0.958904
30 A22 0.753086 0.985915
31 A12 0.743243 0.958904
32 AP2 0.743243 0.958904
33 ADP MG 0.736842 0.905405
34 SRA 0.736111 0.918919
35 ADQ 0.73494 0.945205
36 25L 0.732558 0.985915
37 ADP BEF 0.727273 0.881579
38 BEF ADP 0.727273 0.881579
39 5AL 0.725 0.931507
40 2A5 0.717949 0.918919
41 A1R 0.714286 0.907895
42 AU1 0.714286 0.972222
43 ADP PO3 0.708861 0.943662
44 PAP 0.708861 0.985714
45 ATR 0.708861 0.971429
46 SRP 0.707317 0.906667
47 7D3 0.706667 0.905405
48 25A 0.702381 0.971831
49 ATP MG 0.7 0.905405
50 OAD 0.697674 0.945205
51 RBY 0.6875 0.932432
52 ADV 0.6875 0.932432
53 00A 0.686047 0.883117
54 5SV 0.682353 0.848101
55 8QN 0.682353 0.931507
56 OOB 0.682353 0.931507
57 3OD 0.681818 0.945205
58 BIS 0.681818 0.933333
59 ADP ALF 0.674699 0.87013
60 ALF ADP 0.674699 0.87013
61 AMO 0.674419 0.932432
62 4AD 0.674419 0.92
63 PAJ 0.674419 0.884615
64 GAP 0.670732 0.893333
65 MAP 0.670588 0.945946
66 DLL 0.666667 0.931507
67 ANP MG 0.666667 0.894737
68 VO4 ADP 0.666667 0.931507
69 AHX 0.666667 0.896104
70 ADP VO4 0.666667 0.931507
71 PTJ 0.662921 0.896104
72 3UK 0.659091 0.918919
73 SON 0.658228 0.932432
74 LAD 0.651685 0.860759
75 WAQ 0.651685 0.883117
76 PR8 0.651685 0.85
77 ITT 0.65 0.943662
78 7D4 0.65 0.905405
79 G5P 0.648936 0.921053
80 RAB 0.647059 0.84507
81 ADN 0.647059 0.84507
82 XYA 0.647059 0.84507
83 TXA 0.644444 0.932432
84 1ZZ 0.644444 0.839506
85 ME8 0.644444 0.839506
86 NB8 0.644444 0.896104
87 FYA 0.644444 0.905405
88 6AD 0.642857 0.909091
89 ADP BMA 0.640449 0.918919
90 G3A 0.638298 0.921053
91 DAL AMP 0.632184 0.905405
92 AFH 0.631579 0.884615
93 9SN 0.630435 0.871795
94 GTA 0.625 0.886076
95 YAP 0.623656 0.894737
96 FA5 0.623656 0.906667
97 UP5 0.622449 0.92
98 XAH 0.617021 0.839506
99 AV2 0.616279 0.917808
100 AOC 0.615385 0.821918
101 48N 0.612245 0.896104
102 4UV 0.610526 0.894737
103 TXD 0.606061 0.907895
104 DND 0.606061 0.932432
105 NAX 0.606061 0.873418
106 NXX 0.606061 0.932432
107 NAI 0.606061 0.907895
108 6V0 0.606061 0.896104
109 5N5 0.605634 0.819444
110 5AS 0.604938 0.77907
111 A4P 0.60396 0.843373
112 DAT 0.60241 0.905405
113 A2R 0.602273 0.985915
114 TXE 0.6 0.907895
115 OMR 0.6 0.851852
116 4UU 0.597938 0.894737
117 A A 0.597826 0.944444
118 A4D 0.597222 0.819444
119 5CD 0.597222 0.805556
120 AP0 0.594059 0.896104
121 4TC 0.594059 0.896104
122 A3P 0.592593 0.971429
123 139 0.592233 0.873418
124 T5A 0.592233 0.841463
125 7D5 0.592105 0.878378
126 ATP A A A 0.589474 0.930556
127 LAQ 0.585859 0.839506
128 MYR AMP 0.585106 0.817073
129 YLP 0.58 0.819277
130 UPA 0.578431 0.907895
131 7DD 0.578313 0.985714
132 ADJ 0.576923 0.851852
133 3AM 0.576923 0.929577
134 COD 0.575472 0.811765
135 NAD 0.575472 0.931507
136 3AT 0.574713 0.971831
137 JB6 0.574468 0.883117
138 4UW 0.574257 0.860759
139 EP4 0.573333 0.753247
140 A2P 0.573171 0.957143
141 CNA 0.571429 0.932432
142 TYM 0.568627 0.906667
143 PPS 0.568182 0.873418
144 TYR AMP 0.56701 0.881579
145 DTA 0.565789 0.786667
146 M2T 0.565789 0.734177
147 AR6 AR6 0.565657 0.917808
148 A3D 0.564815 0.918919
149 3DH 0.564103 0.773333
150 G5A 0.563218 0.77907
151 YLB 0.563107 0.819277
152 YLC 0.563107 0.839506
153 AMP DBH 0.561224 0.893333
154 MTA 0.558442 0.773333
155 DTP 0.556818 0.905405
156 AHZ 0.554455 0.817073
157 NA7 0.553191 0.958904
158 IOT 0.552381 0.831325
159 7MD 0.55 0.8625
160 ZAS 0.55 0.766234
161 IMO 0.548781 0.929577
162 YLA 0.54717 0.819277
163 NAE 0.544643 0.894737
164 TAD 0.544554 0.884615
165 A5A 0.544444 0.807229
166 2AM 0.544304 0.943662
167 TSB 0.543478 0.819277
168 6RE 0.54321 0.759494
169 AYB 0.542056 0.809524
170 NAQ 0.539823 0.871795
171 V3L 0.539326 0.971831
172 ARG AMP 0.539216 0.829268
173 AF3 ADP 3PG 0.538462 0.8375
174 SSA 0.538462 0.8
175 LA8 ALF 3PG 0.538462 0.8375
176 ALF ADP 3PG 0.538462 0.8375
177 ZID 0.535088 0.918919
178 LPA AMP 0.533981 0.817073
179 54H 0.532609 0.788235
180 52H 0.532609 0.77907
181 VMS 0.532609 0.788235
182 BTX 0.53211 0.841463
183 J7C 0.53012 0.769231
184 A3N 0.53012 0.786667
185 5X8 0.528736 0.763158
186 BT5 0.527273 0.831325
187 5CA 0.526882 0.8
188 53H 0.526882 0.77907
189 ARU 0.526316 0.860759
190 EAD 0.525862 0.873418
191 RGT 0.525253 0.958904
192 OVE 0.52439 0.905405
193 S4M 0.52381 0.666667
194 7DT 0.522727 0.985714
195 GDP 0.522222 0.92
196 DDS 0.522222 0.878378
197 AVV 0.521277 0.896104
198 NDE 0.521008 0.932432
199 7MC 0.518868 0.841463
200 DSH 0.518072 0.725
201 MAO 0.517647 0.759036
202 LSS 0.515789 0.761364
203 DSZ 0.515789 0.8
204 NSS 0.515789 0.8
205 P5A 0.515464 0.744444
206 DZD 0.513514 0.884615
207 NVA LMS 0.510417 0.761364
208 12D 0.509615 0.785714
209 NAD IBO 0.509091 0.87013
210 M24 0.508772 0.85
211 YLY 0.508772 0.809524
212 P1H 0.508333 0.851852
213 5AD 0.506849 0.746479
214 GJV 0.505882 0.75
215 LEU LMS 0.505155 0.761364
216 G A A A 0.504505 0.871795
217 4TA 0.504505 0.807229
218 NAJ PZO 0.504425 0.848101
219 KAA 0.5 0.752809
220 NDC 0.5 0.871795
221 7D7 0.5 0.743243
222 71V 0.5 0.907895
223 A3G 0.5 0.8
224 128 0.5 0.776471
225 GSU 0.5 0.77907
226 N0B 0.495726 0.819277
227 NJP 0.495495 0.945946
228 ODP 0.495495 0.909091
229 2SA 0.494624 0.932432
230 6C6 0.494505 0.881579
231 SFG 0.494382 0.75
232 0WD 0.491071 0.921053
233 YSA 0.490196 0.77907
234 PO4 PO4 A A A A PO4 0.489796 0.902778
235 6IA 0.48913 0.8375
236 SAM 0.48913 0.690476
237 A7D 0.488636 0.776316
238 6FA 0.488 0.841463
239 FB0 0.487805 0.804598
240 NAJ PYZ 0.487179 0.85
241 IDP 0.483516 0.918919
242 A5D 0.483516 0.786667
243 SA8 0.483516 0.707317
244 MHZ 0.483146 0.697674
245 PGS 0.483146 0.883117
246 D5M 0.482353 0.878378
247 DA 0.482353 0.878378
248 NEC 0.482353 0.746667
249 NIA 0.481928 0.822785
250 Y3J 0.480519 0.726027
251 FAD 0.480315 0.851852
252 FAS 0.480315 0.851852
253 FDA 0.48 0.833333
254 N6P 0.479592 0.915493
255 GGZ 0.479167 0.825
256 SAH 0.478261 0.74359
257 SAI 0.478261 0.734177
258 NPW 0.477477 0.886076
259 NDP 0.477477 0.921053
260 AAM 0.476744 0.971429
261 AMZ 0.47561 0.916667
262 C2R 0.47561 0.90411
263 A A A 0.474747 0.905405
264 GTP 0.473684 0.92
265 U A G G 0.473684 0.883117
266 SMM 0.473684 0.686047
267 TXP 0.473214 0.921053
268 NZQ 0.473214 0.909091
269 A3S 0.47191 0.810811
270 AMP NAD 0.470588 0.881579
271 SFD 0.46875 0.734043
272 AIR 0.468354 0.901408
273 AAT 0.468085 0.707317
274 EEM 0.468085 0.690476
275 Z5A 0.466667 0.77907
276 7C5 0.466667 0.818182
277 J7V 0.466667 0.833333
278 62F 0.465649 0.8625
279 FAY 0.462121 0.8625
280 ETB 0.461538 0.833333
281 DCA 0.461538 0.823529
282 A3T 0.461538 0.821918
283 A6D 0.46 0.722892
284 A U 0.459459 0.87013
285 6K6 0.459184 0.930556
286 GEK 0.459184 0.7375
287 RFL 0.458647 0.821429
288 S7M 0.458333 0.690476
289 NAP 0.458333 0.945205
290 4YB 0.457944 0.761364
291 WSA 0.454545 0.788235
292 TAP 0.454545 0.907895
293 FNK 0.454545 0.804598
294 COA 0.453782 0.823529
295 0T1 0.453782 0.823529
296 101 0.453488 0.878378
297 XNP 0.452174 0.873418
298 NA0 0.45082 0.932432
299 7RP 0.448276 0.928571
300 GP3 0.446809 0.921053
301 TM1 0.446602 0.77381
302 APU 0.446429 0.894737
303 PUA 0.445378 0.884615
304 V1N 0.443396 0.917808
305 7RA 0.443182 0.957747
306 30N 0.442623 0.752688
307 CAO 0.442623 0.795455
308 AMX 0.442623 0.833333
309 COS 0.442623 0.804598
310 ACK 0.44186 0.861111
311 QQY 0.44186 0.815789
312 649 0.441441 0.744444
313 0UM 0.44 0.698795
314 NHD 0.439655 0.905405
315 CMX 0.439024 0.823529
316 SCO 0.439024 0.823529
317 GCP 0.438776 0.896104
318 8BR 0.438202 0.906667
319 GNH 0.4375 0.907895
320 3AD 0.4375 0.805556
321 62X 0.435644 0.666667
322 ACO 0.435484 0.795455
323 FCX 0.435484 0.795455
324 FAM 0.435484 0.804598
325 GNP 0.434343 0.896104
326 NMX 0.433071 0.76087
327 MGP 0.43299 0.884615
328 PLP AAD 0.432203 0.741573
329 26A 0.432099 0.763158
330 HAX 0.432 0.804598
331 K15 0.431373 0.682353
332 DG1 0.430894 0.921053
333 1DG 0.430894 0.921053
334 QQX 0.430233 0.805195
335 2VA 0.430108 0.8
336 S8M 0.43 0.759494
337 2MC 0.429688 0.769231
338 3KK 0.428571 0.804598
339 6G0 0.428571 0.884615
340 FYN 0.428571 0.823529
341 P5F 0.428571 0.823529
342 NAD BBN 0.428571 0.841463
343 U G A 0.427481 0.839506
344 AS 0.426966 0.833333
345 FAI 0.426966 0.916667
346 RMB 0.426966 0.873239
347 1RB 0.425287 0.885714
348 MCD 0.425197 0.804598
349 OXK 0.425197 0.804598
350 COK 0.425197 0.804598
351 CA6 0.425197 0.729167
352 SOP 0.425197 0.804598
353 G1R 0.424242 0.907895
354 CC5 0.423077 0.816901
355 SXZ 0.423077 0.710843
356 F2N 0.422535 0.813953
357 NAD CJ3 0.422222 0.811765
358 ANZ 0.422018 0.8
359 CMC 0.421875 0.804598
360 CO6 0.421875 0.804598
361 1VU 0.421875 0.795455
362 ZDA 0.421053 0.864865
363 GDD 0.420561 0.884615
364 GKE 0.420561 0.884615
365 GDC 0.420561 0.884615
366 NFD 0.420168 0.883117
367 GSP 0.42 0.873418
368 D3Y 0.42 0.789474
369 MC4 0.419847 0.76087
370 3L1 0.419753 0.773333
371 3D1 0.419753 0.773333
372 FA9 0.41958 0.864198
373 5GP 0.419355 0.906667
374 G 0.419355 0.906667
375 KB1 0.419048 0.698795
376 SCD 0.418605 0.823529
377 CAJ 0.418605 0.804598
378 2BA 0.417582 0.915493
379 CMP 0.417582 0.901408
380 SO8 0.416667 0.789474
381 N01 0.416667 0.905405
382 VRT 0.416667 0.769231
383 3HC 0.415385 0.813953
384 A1S 0.415385 0.804598
385 BCO 0.415385 0.804598
386 IVC 0.415385 0.813953
387 MLC 0.415385 0.804598
388 1HE 0.415385 0.786517
389 NMN AMP PO4 0.415254 0.87013
390 2FA 0.414634 0.813333
391 MGO 0.414141 0.860759
392 3NZ 0.413462 0.782051
393 MCA 0.412214 0.795455
394 CAA 0.412214 0.813953
395 YE1 0.412214 0.813953
396 COO 0.412214 0.804598
397 GAV 0.411765 0.884615
398 P2P 0.411111 0.902778
399 JLN 0.411111 0.890411
400 ZZB 0.410256 0.77381
401 CNV FAD 0.410072 0.793103
402 SCA 0.409091 0.804598
403 RP1 0.409091 0.842105
404 103 0.409091 0.837838
405 2CP 0.409091 0.795455
406 SP1 0.409091 0.842105
407 PAX 0.408 0.829268
408 FAD NBT 0.407143 0.75
409 NVA 2AD 0.40625 0.74359
410 COW 0.406015 0.795455
411 BYC 0.406015 0.804598
412 2KQ 0.406015 0.786517
413 COF 0.406015 0.786517
414 3CP 0.406015 0.804598
415 IRC 0.406015 0.813953
416 1GZ 0.406015 0.795455
417 HGG 0.406015 0.804598
418 CA8 0.406015 0.729167
419 G2P 0.405941 0.884615
420 SLU 0.404959 0.770115
421 U A C C 0.404959 0.858974
422 RBZ 0.404494 0.849315
423 1CZ 0.404412 0.795455
424 BCA 0.402985 0.795455
425 FAQ 0.402985 0.804598
426 4CA 0.402985 0.795455
427 MTP 0.402439 0.730769
428 8OD 0.402062 0.945205
429 CO7 0.401515 0.804598
430 DAL FAD PER 0.401408 0.809524
431 G2R 0.4 0.884615
432 HXC 0.4 0.786517
433 ENQ 0.4 0.916667
434 GMV 0.4 0.896104
435 GRA 0.4 0.804598
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4FCW; Ligand: ADP; Similar sites found: 421
This union binding pocket(no: 1) in the query (biounit: 4fcw.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5KSP GDP 0.0004199 0.46262 None
2 4BAS GNP 0.00184 0.44636 None
3 1ION ADP 0.001849 0.42453 None
4 2NCD ADP 0.000004024 0.58696 1.28617
5 4E03 ADP 0.001864 0.43297 1.45631
6 3U6B GDP 0.00007896 0.50941 1.60772
7 3U6K GDP 0.00013 0.49226 1.60772
8 1D8T GDP 0.0001567 0.48844 1.60772
9 4G5G GDP 0.0001643 0.48747 1.60772
10 5JBQ GDP 0.0001792 0.4857 1.60772
11 2HCJ GDP 0.0001131 0.47351 1.60772
12 2BVN GNP 0.0003258 0.44961 1.60772
13 5KSZ GCP 0.0009143 0.43865 1.60772
14 2Z48 A2G 0.01782 0.40185 1.60772
15 4P3Y GDP 0.00007433 0.48092 1.64835
16 1MR3 G3D 0.000269 0.47148 1.65746
17 4XSH GSP 0.001214 0.41123 1.67598
18 1FP6 ADP 0.000447 0.44343 1.7301
19 5HCN GCP 0.001586 0.43619 1.91571
20 2VVG ADP 0.0000004922 0.50431 1.92926
21 2ZPA ADP 0.0001134 0.49931 1.92926
22 3TK1 GDP 0.0002275 0.49412 1.92926
23 5HR5 ADP 0.000196 0.45143 1.92926
24 4GOX A3P 0.0001856 0.42125 1.92926
25 3RC3 ANP 0.007639 0.41362 1.92926
26 4A01 2PN 0.01062 0.40669 1.92926
27 5KUT GDP 0.0001464 0.48357 2.1164
28 4YDS ATP 0.00008438 0.51546 2.19298
29 4R43 GDP 0.00001984 0.53059 2.2508
30 4PPF FLC 0.0002605 0.49799 2.2508
31 2ZR9 DTP 0.0004638 0.46631 2.2508
32 3FWY ADP 0.0002293 0.44592 2.2508
33 1ZCB GDP 0.0001974 0.40581 2.2508
34 3DEF GDP 0.0002567 0.45378 2.29008
35 4QM7 GTP 0.000533 0.46347 2.33918
36 3MJH GTP 0.0002921 0.40055 2.38095
37 4PX9 ADP 0.0005329 0.46943 2.39726
38 3DKP ADP 0.001693 0.43989 2.44898
39 2EW1 GNP 0.0005549 0.47309 2.48756
40 1T5C ADP 0.0000008719 0.62947 2.57235
41 3LRE ADP 0.000001091 0.61962 2.57235
42 2XT3 ADP 0.000005048 0.58285 2.57235
43 2DPY ADP 0.00007829 0.51707 2.57235
44 2WHX ADP 0.0002299 0.49701 2.57235
45 1BG2 ADP 0.000001642 0.48668 2.57235
46 4AG5 ADP 0.0003938 0.48468 2.57235
47 2JLR ANP 0.002 0.41605 2.57235
48 4ZG4 VO4 ADP 0.0005193 0.40862 2.57235
49 1H65 GDP 0.0001091 0.43735 2.59259
50 4M9Q GNP 0.00108 0.40358 2.64317
51 1WF3 GNP 0.0004373 0.48357 2.65781
52 3EC1 GDP 0.00127 0.4406 2.71003
53 4XL8 MNA 0.01195 0.40656 2.87081
54 4J0Q GDP 0.00007847 0.50954 2.89389
55 1SVK ALF GDP 0.0006865 0.47892 2.89389
56 3EWA ANP 0.0001793 0.47123 2.89389
57 5LTJ ADP 0.0005947 0.4557 2.89389
58 2OBM ADP 0.003452 0.43537 2.89389
59 5LTJ BEF 0.006802 0.42547 2.89389
60 2XAU ADP 0.002612 0.41908 2.89389
61 4IDN GNP 0.0004282 0.41444 2.89389
62 1GZ4 FUM 0.0107 0.40221 2.89389
63 4ZNL BEF ADP 0.0002174 0.47571 2.91971
64 2CBZ ATP 0.000007263 0.57865 2.95359
65 1G3Q ADP 0.001255 0.44085 2.95359
66 2PL3 ADP 0.001605 0.44634 2.9661
67 3UIE ANP 0.0005775 0.44775 3
68 1B0U ATP 0.001683 0.41843 3.05344
69 1MKY GDP 0.0001316 0.49201 3.21543
70 2VF7 ADP 0.0001971 0.47766 3.21543
71 3TBK ANP 0.0005068 0.47688 3.21543
72 1XMV ADP 0.0003668 0.46531 3.21543
73 1D2E GDP 0.0002149 0.4556 3.21543
74 2FNA ADP 0.0001727 0.42882 3.21543
75 1XKV ATP 0.001905 0.42532 3.21543
76 5XDR ADP 0.003129 0.42266 3.21543
77 4IHQ ADP 0.008975 0.41023 3.21543
78 2F5X ASP 0.0152 0.40452 3.21543
79 3AQ4 GDP 0.0001276 0.4863 3.26087
80 3B5J 12D 0.0001155 0.50871 3.29218
81 1JI0 ATP 0.0002507 0.49203 3.33333
82 1YTM ATP 0.0001177 0.43595 3.38346
83 4D0G GTP 0.000304 0.4205 3.42857
84 1RYH GNP 0.001104 0.43509 3.44828
85 3Q9L ATP 0.004698 0.41456 3.46154
86 4YLG GDP 0.0003393 0.44086 3.46821
87 3COB ADP 0.000007011 0.57719 3.53698
88 5CK5 GDP 0.00001315 0.54695 3.53698
89 2RCN GDP 0.00003481 0.51912 3.53698
90 2Q2Y ADP 0.0003003 0.50912 3.53698
91 2Q2Y MKR 0.0002977 0.50807 3.53698
92 3ZFD ANP 0.00006029 0.50419 3.53698
93 4MKG AP5 0.0007681 0.4885 3.53698
94 2QEN ADP 0.0001073 0.46025 3.53698
95 2C77 GNP 0.0005083 0.41957 3.53698
96 2C78 GNP 0.0005693 0.41117 3.53698
97 1SQ5 ADP 0.0002848 0.47034 3.57143
98 1KAO GDP 0.0002195 0.44772 3.59281
99 2CJW GDP 0.00004347 0.51459 3.64583
100 1DS6 GDP 0.0004615 0.46641 3.64583
101 2IXE ATP 0.0002964 0.41842 3.69004
102 2X77 GDP 0.0004748 0.46018 3.7037
103 2WJG GDP 0.00003629 0.51827 3.7234
104 2WIC GNP 0.0002444 0.47339 3.74532
105 3LXR GDP 0.0004207 0.45297 3.78378
106 1G4U GDP 0.0008239 0.41818 3.80435
107 1GOJ ADP 0.000001082 0.6207 3.85852
108 4FRZ ADP 0.000007577 0.57295 3.85852
109 5TSH ADP 0.00008179 0.51898 3.85852
110 5M04 GDP 0.0001011 0.50424 3.85852
111 5TSH ANP 0.0000779 0.5027 3.85852
112 1XP8 AGS 0.0001112 0.50225 3.85852
113 1OXV ANP 0.0001943 0.49056 3.85852
114 3P4X ADP 0.00009438 0.4769 3.85852
115 4D0N GDP 0.0006482 0.44761 3.85852
116 4XGU ADP 0.0004994 0.43613 3.85852
117 2OM2 GDP 0.0001921 0.43399 3.85852
118 1QHG ATP 0.001603 0.42747 3.85852
119 3FVQ ATP 0.0002915 0.42728 3.85852
120 3FKQ ATP 0.001329 0.41719 3.85852
121 1Y3A GDP 0.0002551 0.41486 3.85852
122 4RZ3 ADP 0.001934 0.4103 3.85852
123 2BEK ATP 0.0004558 0.41471 3.89105
124 4PC3 GDP 0.0005296 0.44019 3.90071
125 3GCZ SAM 0.01428 0.40046 3.90071
126 3B7G ANP 0.003876 0.41839 3.91304
127 1KO8 6PG 0.002617 0.43521 4
128 2HT6 GDP 0.00001229 0.54835 4.02299
129 3GJ4 GDP 0.0002131 0.48217 4.0724
130 3GJ7 GDP 0.0002714 0.47724 4.0724
131 3GJ5 GDP 0.0003653 0.46539 4.0724
132 5EE5 GTP 0.0003838 0.4185 4.09357
133 5X40 ACP 0.0008385 0.46452 4.10959
134 2EFE GNH 0.001237 0.42615 4.11985
135 1NRJ GTP 0.000439 0.42266 4.12844
136 3RAB GNP 0.0003929 0.48404 4.14201
137 2GDJ ANP 0.0002956 0.4755 4.16667
138 1Z2A GDP 0.0002104 0.41841 4.16667
139 2C9O ADP 0.0000000136 0.59031 4.18006
140 4B47 GDP 0.00004764 0.51999 4.18006
141 1SKQ GDP 0.00007297 0.51106 4.18006
142 2IS6 ADP 0.0001009 0.49741 4.18006
143 1F9V ADP 0.00001395 0.48999 4.18006
144 4LYA ATP 0.0002362 0.47407 4.18006
145 5MZN ADP 0.0006602 0.47119 4.18006
146 4WZA ADP 0.004486 0.46534 4.18006
147 4WZA ACP 0.004486 0.46534 4.18006
148 3GJX GTP 0.001061 0.46493 4.18006
149 4IEE AGS 0.002466 0.43734 4.18006
150 1GOT GDP 0.0001772 0.42739 4.18006
151 4P4T GDP 0.0008879 0.41906 4.18006
152 4RD0 GDP 0.0004681 0.4143 4.18006
153 2WJH GDP 0.0002682 0.47153 4.21687
154 2WJH FLC 0.001871 0.43538 4.21687
155 1PUJ GNP 0.0002777 0.45255 4.25532
156 2XTN GTP 0.000274 0.41448 4.2735
157 1G6H ADP 0.000002089 0.60596 4.28016
158 3KTA AP5 0.0002176 0.45481 4.3956
159 2D2F ADP 0.0001832 0.50739 4.4
160 1HTW ADP 0.0001857 0.47884 4.43038
161 3H4S ADP 0.000004207 0.49074 4.44444
162 4WOP CTP 0.00177 0.41938 4.44444
163 5IFS ADP 0.000007824 0.52951 4.50161
164 1IN4 ADP 0.000007447 0.49694 4.50161
165 4DCT GDP 0.0002608 0.47209 4.50161
166 1YZG GDP 0.0002938 0.46972 4.50161
167 1OW3 GDP 0.0006844 0.46037 4.50161
168 4PJ3 ANP 0.0002383 0.45862 4.50161
169 2GK6 ADP 0.001719 0.4506 4.50161
170 3IO3 ADP 0.0003999 0.42861 4.50161
171 4A4Z ANP 0.004838 0.41845 4.50161
172 2J5V PCA 0.01175 0.4135 4.50161
173 1JQN DCO 0.005789 0.4104 4.50161
174 3GJ0 GDP 0.0002342 0.48025 4.52489
175 3GJ3 GDP 0.0002427 0.47952 4.52489
176 1SVI GDP 0.0001169 0.5012 4.61538
177 5BXQ GDP 0.0004001 0.46358 4.62963
178 1XEX ATP 0.0002058 0.40389 4.65116
179 2OZE AGS 0.0001898 0.4406 4.69799
180 5UQW GDP 0.0002956 0.40727 4.7619
181 1ZJ6 G3D 0.0002331 0.47432 4.81283
182 1V6A TRE 0.01333 0.40982 4.81928
183 3DC4 ADP 0.000005718 0.57337 4.82315
184 2ZFI ADP 0.000037 0.51788 4.82315
185 3WYA GDP 0.00006331 0.50693 4.82315
186 3AB3 GDP 0.0002763 0.48337 4.82315
187 1DAR GDP 0.0004531 0.46679 4.82315
188 1Z6T ADP 0.0006507 0.4299 4.82315
189 1WDT GTP 0.001604 0.4067 4.82315
190 3VX3 ADP 0.002241 0.40218 4.83871
191 1JJV ATP 0.000362 0.48606 4.85437
192 2BCG GDP 0.0001873 0.44283 4.85437
193 2FH5 GTP 0.0008999 0.41093 4.86486
194 1U0J ADP 0.0003254 0.47977 4.86891
195 3SFV GDP 0.0001523 0.49559 4.97238
196 4YMU ATP 0.00012 0.50066 5
197 4NON GDP 0.0007234 0.45724 5
198 5H67 ATP 0.00429 0.41637 5.02513
199 2A5F GTP 0.0004288 0.40484 5.14286
200 1YQT ADP 0.000003116 0.59274 5.14469
201 1S9D GDP 0.00009632 0.4919 5.14469
202 1I4D GDP 0.0002792 0.48297 5.14469
203 1O3Y GTP 0.0002823 0.41441 5.14469
204 2J59 GTP 0.0004504 0.40822 5.14469
205 1K6M AGS 0.0005846 0.40755 5.14469
206 4LHW GNP 0.0003697 0.40012 5.17241
207 2J0V GDP 0.0005847 0.45604 5.18868
208 1R0X ATP 0.0001065 0.47226 5.24476
209 5XCO GDP 0.0001236 0.46627 5.26316
210 1M2O GNP 0.001332 0.45846 5.26316
211 5J1J ANP 0.0002859 0.41416 5.26316
212 1ZD9 GDP 0.0002495 0.43703 5.31915
213 4V0K GDP 0.001531 0.40771 5.32544
214 2QN6 GDP 0.00008599 0.50763 5.37634
215 1JJ7 ADP 0.000002895 0.60019 5.38462
216 1W5T ADP 0.000001212 0.54096 5.46624
217 1W5T ANP 0.000002781 0.50862 5.46624
218 5IRC GDP 0.002862 0.41686 5.47264
219 3N5C GDP 0.00005265 0.51069 5.55556
220 3T1O GDP 0.00007508 0.4998 5.55556
221 1F6B GDP 0.00008665 0.494 5.55556
222 3T12 GDP ALF 0.000229 0.42462 5.55556
223 3PCR GTP 0.0005891 0.40522 5.55556
224 4KAX GTP 0.0003113 0.42021 5.59006
225 3PQC GDP 0.0004107 0.45369 5.64103
226 2W2X GSP 0.001559 0.40133 5.64516
227 1RRC ADP 0.00002854 0.46225 5.64784
228 3NKV GNP 0.0002214 0.40588 5.71429
229 3QBT GNP 0.0002899 0.40217 5.71429
230 2VOH CIT 0.002904 0.43321 5.73248
231 1V8K ANP 0.00003018 0.52203 5.78778
232 5FG3 GDP 0.0001484 0.49621 5.78778
233 4PFO ADP 0.0002453 0.49391 5.78778
234 4LC1 GDP 0.0002812 0.47652 5.78778
235 5GOE GDP 0.0002028 0.46734 5.78778
236 5GJC ATP 0.0005436 0.46307 5.78778
237 5LB3 ADP 0.001443 0.44857 5.78778
238 1VG8 GNP 0.0002343 0.4001 5.7971
239 3CPJ GDP 0.00007186 0.47666 5.8296
240 4WZ6 ATP 0.00004064 0.53668 5.86207
241 4R98 GNH 0.000513 0.46425 5.90406
242 2QTV GNP 0.0003242 0.40805 5.98802
243 1YRB GDP 0.0002157 0.45668 6.10687
244 3BOS CDP 0.00007048 0.50474 6.10932
245 5VGR GDP 0.0005694 0.4311 6.10932
246 4XTR ADP 0.0005511 0.42319 6.10932
247 1M7G AV2 0.00009972 0.50453 6.16114
248 3NHB ADP 0.0000141 0.55942 6.20915
249 3DOE GTP 0.0007223 0.40228 6.25
250 4CVN ADP 0.000163 0.5013 6.28272
251 1Z0K GTP 0.0006724 0.40298 6.39535
252 2AWN ADP 0.000001483 0.61062 6.43087
253 2OG2 MLI 0.0001878 0.51337 6.43087
254 5I0H ADP BEF 0.0002069 0.43303 6.43087
255 1TQ4 GDP 0.0002552 0.42869 6.43087
256 1G16 GDP 0.0001681 0.4293 6.47059
257 1VG1 GDP 0.00006505 0.49971 6.48649
258 4TTQ ATP 0.004481 0.42001 6.51163
259 1G8S MET 0.00301 0.44539 6.52174
260 2F9L GDP 0.00008157 0.434 6.53266
261 3A1S GDP 0.0001531 0.48269 6.58915
262 1KY3 GDP 0.0001364 0.46512 6.59341
263 3B9Q MLI 0.0006476 0.48183 6.62252
264 1UPT GTP 0.0003977 0.41793 6.66667
265 3TKL GTP 0.0001717 0.41467 6.74157
266 1FNN ADP 0.000002252 0.52162 6.75241
267 1JWY ADP 0.00009492 0.49219 6.75241
268 5UWT GNP 0.0005568 0.47849 6.75241
269 3M1I GTP 0.0005653 0.47817 6.75241
270 3VMF GTP 0.00105 0.46344 6.75241
271 3WXM GTP 0.001482 0.45623 6.75241
272 1JWY GDP 0.0008513 0.43206 6.75241
273 4YS0 ADP 0.0006795 0.4309 6.75241
274 3RLF ANP 0.00009407 0.43022 6.75241
275 1FQJ GDP 0.0003893 0.41052 6.75241
276 1FQK GDP 0.000391 0.41039 6.75241
277 1CR1 TTP 0.0001572 0.49494 6.75676
278 5L3R GCP 0.0006393 0.40606 6.82594
279 3W5J GDP 0.00005302 0.53032 6.86275
280 3RWO GDP 0.0001523 0.41331 7.02703
281 1GP2 GDP 0.0002061 0.41951 7.04225
282 1LVG ADP 0.00001776 0.54899 7.07071
283 3GGU 017 0.01912 0.40657 7.07071
284 4D81 ADP 0.000004073 0.52969 7.07396
285 3MD0 GDP 0.00006685 0.5129 7.07396
286 4KFU ACP 0.0003614 0.48678 7.07547
287 3Q85 GNP 0.00004426 0.51423 7.10059
288 5IRR GSP 0.0004512 0.41796 7.14286
289 3IIJ ADP 0.0001063 0.49636 7.22222
290 5JCZ GDP 0.00008045 0.45655 7.26257
291 3B6C SDN 0.01097 0.41061 7.26496
292 1S8F GDP 0.0003257 0.45846 7.34463
293 4MKF AP5 0.001202 0.47979 7.37327
294 5IRN ADP 0.00004305 0.48492 7.3955
295 5JCP GDP ALF 0.0008505 0.42428 7.3955
296 1IHU AF3 0.0003641 0.41747 7.3955
297 1IHU ADP 0.0004014 0.40967 7.3955
298 2PZE ATP 0.0000243 0.4636 7.42358
299 1UAD GNP 0.0003062 0.40658 7.42857
300 4C4P GNP 0.0002303 0.49707 7.51445
301 2ZTS ADP 0.0009322 0.41478 7.56972
302 3GJ8 GDP 0.0003866 0.46426 7.6087
303 2QZ4 ADP 0.0000005418 0.57963 7.63359
304 1L2T ATP 0.0001769 0.41485 7.65957
305 1VG0 GDP 0.0001443 0.4894 7.71704
306 1VG9 GDP 0.0001708 0.48051 7.71704
307 1U8Z GDP 0.0002532 0.4145 7.7381
308 1VHT BA3 0.006423 0.40288 7.79817
309 1GWN GTP 0.0005767 0.46826 7.80488
310 3Q72 GNP 0.00004324 0.52202 7.83133
311 2A5J GDP 0.00008935 0.48278 7.8534
312 5BQ5 ADP BEF 0.0000292 0.50385 7.93651
313 1W7J ADP BEF 0.0003571 0.4395 7.94702
314 3A4M ADP 0.000113 0.50919 8.07692
315 4R2I ANP 0.009074 0.41472 8.09524
316 5H56 TYD 0.000973 0.47149 8.20513
317 5H56 ADP 0.000973 0.47149 8.20513
318 2Y65 ADP 0.000004772 0.48861 8.36013
319 4U5X GNP 0.001555 0.40703 8.42697
320 2V7Q ADP 0.00002444 0.52634 8.45588
321 1W0J ADP BEF 0.00003664 0.52237 8.45588
322 1W0J ADP 0.0003864 0.46954 8.45588
323 2CK3 ANP 0.00006173 0.46006 8.45588
324 2V7Q ATP 0.0004137 0.45377 8.45588
325 2CK3 ADP 0.00006666 0.43458 8.45588
326 1KSH GDP 0.001043 0.45608 8.55263
327 5EP2 AZU 0.001952 0.40703 8.59375
328 1RE0 GDP 0.00003284 0.52778 8.59729
329 1Z0A GDP 0.00006082 0.48982 8.62069
330 5TB5 GDP 0.0001699 0.47047 8.66667
331 5N69 ADP 0.0002404 0.45442 8.68167
332 1M7B GTP 0.0004067 0.42079 8.69565
333 5TAR GDP 0.0001916 0.45862 8.78378
334 1TU3 GNP 0.0001633 0.40765 8.86076
335 1XX6 ADP 0.003243 0.41572 8.90052
336 2A9K GDP 0.0001732 0.48826 8.96861
337 1FZQ GDP 0.0002755 0.47693 9.00322
338 4GOJ GNP 0.000878 0.46164 9.00322
339 4BQS ADP 0.0001349 0.4915 9.09091
340 2W83 GTP 0.0002373 0.41715 9.09091
341 1G7S GDP 0.00011 0.48926 9.32476
342 2HV8 GTP 0.0002042 0.49775 9.375
343 2PEZ DAT 0.0002177 0.50654 9.49721
344 3ZIA ATP 0.0001796 0.47951 9.52381
345 3ZIA ADP 0.00007384 0.47528 9.52381
346 1QHH ATP 0.002906 0.42413 9.56522
347 3VPD BUA 0.007446 0.42667 9.60854
348 3QF7 ANP 0.0002922 0.47998 9.6463
349 5M7P ADP 0.0001055 0.45628 9.6463
350 3BFV ADP 0.002705 0.43033 9.6463
351 4DKX GDP 0.0001522 0.48904 9.72222
352 4U00 ADP 0.000001146 0.62113 9.83607
353 1D5C GDP 0.0001306 0.45546 9.87654
354 2BIF ANP 0.0007405 0.48166 9.96785
355 2BIF SIN 0.001218 0.48166 9.96785
356 2CE7 ADP 0.000001162 0.58327 10.2894
357 3E70 GDP 0.00261 0.42627 10.2894
358 2HF9 GSP 0.0002266 0.44766 10.6195
359 3CNL GNP 0.0004686 0.47213 10.687
360 2VB6 ADP BEF 0.000419 0.40956 10.7383
361 4LPS GDP 0.0004252 0.46237 10.7438
362 2FAH GDP 0.00002163 0.49694 10.9325
363 2G77 GDP 0.0002155 0.44904 11.1111
364 1HE1 GDP 0.0004974 0.41926 11.1111
365 1NJF ADP 0.0000003138 0.61954 11.2
366 1NJF AGS 0.00000069 0.6092 11.2
367 2CHG ANP 0.0000006159 0.54634 11.5044
368 1OIV GDP 0.0001289 0.41469 11.5183
369 1OIX GDP 0.0001784 0.4122 11.5183
370 5E95 GDP 0.0001735 0.45109 11.9048
371 1Y63 ADP 0.0001542 0.48877 11.9565
372 2KIN ADP 0.000003367 0.59633 12
373 2UZI GTP 0.000456 0.48092 12.0482
374 1WQ1 GDP 0.0002522 0.41599 12.0482
375 2D7D ADP 0.0002976 0.47536 12.2186
376 1F5N GNP 0.0001355 0.40828 12.2186
377 2FFQ GSP 0.0007814 0.47136 12.2807
378 3EZ2 ADP 0.001185 0.45269 12.5402
379 2GCO GNP 0.0009082 0.42296 13.4328
380 5L3W GDP 0.001873 0.42588 14.3791
381 5L3V GDP 0.001647 0.42821 14.4695
382 2W58 ADP 0.000003257 0.59073 14.8515
383 5L3S GNP 0.0006272 0.40047 14.8649
384 1KK1 GNP 0.00006234 0.51436 15.1125
385 3BC1 GNP 0.0002587 0.40425 15.2542
386 5MVR ADP 0.0001407 0.49064 15.4321
387 4V03 ADP 0.000977 0.4365 15.9533
388 4DID GDP 0.00101 0.44515 16.0622
389 5HPY GDP 0.0006839 0.42752 16.2162
390 2NGR GDP 0.0003495 0.46627 16.2304
391 1GRN GDP 0.0004671 0.43313 16.2304
392 1A4R GNH 0.0009137 0.42297 16.2304
393 1A4R GDP 0.0009615 0.41507 16.2304
394 4ITR GDP 0.001232 0.40986 16.2304
395 2WMO GTP 0.0008346 0.44015 16.3158
396 4ZI2 GNP 0.001174 0.40187 16.5414
397 1OFH ADP 0.000000002345 0.68382 16.7203
398 3T5G GDP 0.0002985 0.47215 17.1271
399 4YC7 GNP 0.00134 0.45291 17.1271
400 1Z0F GDP 0.00009766 0.49163 17.3184
401 2FSH ANP 0.0008667 0.43603 17.3633
402 2IYL GDP 0.0009265 0.45219 17.9577
403 1G6O ADP 0.0004874 0.45022 18.0064
404 2FJU GSP 0.001366 0.40268 18.6495
405 5UFQ GNP 0.0003101 0.40089 19.6721
406 1B7T ADP 0.00007406 0.48569 19.8718
407 5DI3 GNP 0.0009828 0.40396 22.1622
408 1KK8 BEF ADP 0.0002242 0.44784 22.3022
409 4HI0 GDP 0.00002761 0.46758 22.6131
410 5FTB ANP 0.0003334 0.4583 22.8296
411 5FHD ADP ALF 0.0002981 0.42979 22.8296
412 3CH5 GDP 0.0002882 0.4701 23.0769
413 3KUD GDP 0.000239 0.43017 25.9259
414 5KDO GDP 0.0001311 0.43969 28.3784
415 2D7C GTP 0.0001821 0.41155 28.5714
416 1NY5 ADP 0.00009769 0.46473 28.6174
417 4QOS ADP 0.0001842 0.46978 30.9434
418 3WY9 GDP 0.00005337 0.51762 34.375
419 3KJI ADP 0.004666 0.41927 35.8268
420 3DZD ADP 0.00022 0.459 36.0129
421 5J1S ATP 0.0000003646 0.51497 36.6559
Pocket No.: 2; Query (leader) PDB : 4FCW; Ligand: ADP; Similar sites found: 30
This union binding pocket(no: 2) in the query (biounit: 4fcw.bio3) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2YIP YIO 0.02326 0.40504 None
2 2Z49 AMG 0.005479 0.41911 1.60772
3 4P32 ADP 0.0008377 0.40087 2.81124
4 1G7C 5GP 0.009463 0.40472 3.19149
5 1NST A3P 0.003181 0.40226 3.21543
6 5GVR LMR 0.003311 0.40672 3.4188
7 3IUY AMP 0.008607 0.40248 3.50877
8 3FYH ADP 0.0002834 0.40175 3.53698
9 4ITM ATP 0.02088 0.4006 3.85852
10 2Q37 3AL 0.01917 0.40111 3.8674
11 5E5U MLI 0.003441 0.40652 4.0201
12 2ZE7 DST 0.02287 0.40008 4.74308
13 3CV2 OXL 0.01229 0.40957 5.46624
14 1EK0 GNP 0.0002923 0.4003 5.88235
15 4XTR ATP 0.0006162 0.40117 6.10932
16 1OYY AGS 0.01144 0.40083 6.10932
17 4NCN GTP 0.0006838 0.40042 6.10932
18 3AQT RCO 0.01932 0.40173 6.12245
19 1YVD GNP 0.0002443 0.4043 6.50888
20 4I42 1HA 0.04751 0.41199 7.01754
21 4LX0 BEF GDP 0.0001904 0.40282 7.34463
22 1ZC3 GNP 0.0003058 0.40027 7.42857
23 3REF GDP 0.0006527 0.40652 7.73196
24 4KVG GTP 0.0002985 0.40096 7.7381
25 5SZH GNP 0.0001808 0.40273 7.84314
26 1Z06 GNP 0.0004156 0.40293 9.52381
27 1LFD GNP 0.0002913 0.40096 11.976
28 2GCN GDP 0.0008999 0.40188 13.4328
29 1XTQ GDP 0.0005528 0.40288 17.5141
30 2BME GNP 0.0005167 0.40001 25.2688
Pocket No.: 3; Query (leader) PDB : 4FCW; Ligand: ADP; Similar sites found: 6
This union binding pocket(no: 3) in the query (biounit: 4fcw.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4L80 OXL 0.01563 0.40007 2.2508
2 2RCU BUJ 0.02629 0.42481 2.89389
3 3NTD FAD 0.04861 0.40017 2.89389
4 2H04 4UN 0.00974 0.41051 3.21543
5 4M7V RAR 0.04474 0.40635 4
6 4M7V NAP 0.02703 0.40635 4
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