Receptor
PDB id Resolution Class Description Source Keywords
4XGU 2.3 Å NON-ENZYME: OTHER STRUCTURE OF C. ELEGANS PCH-2 CAENORHABDITIS ELEGANS MEIOTIC RECOMBINATION AAA+ ATPASE PROTEIN REMODELER ATP-BPROTEIN
Ref.: TRIP13 IS A PROTEIN-REMODELING AAA+ ATPASE THAT CAT MAD2 CONFORMATION SWITCHING. ELIFE V. 4 07367 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP E:503;
B:501;
Valid;
Valid;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
SO4 F:501;
E:501;
D:502;
A:501;
C:501;
E:502;
D:501;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4XGU 2.3 Å NON-ENZYME: OTHER STRUCTURE OF C. ELEGANS PCH-2 CAENORHABDITIS ELEGANS MEIOTIC RECOMBINATION AAA+ ATPASE PROTEIN REMODELER ATP-BPROTEIN
Ref.: TRIP13 IS A PROTEIN-REMODELING AAA+ ATPASE THAT CAT MAD2 CONFORMATION SWITCHING. ELIFE V. 4 07367 2015
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 4XGU - 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 1068 families.
1 4XGU - 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 922 families.
1 4XGU - 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 : 4XGU; Ligand: ADP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 4xgu.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 4XGU; Ligand: ADP; Similar sites found: 435
This union binding pocket(no: 2) in the query (biounit: 4xgu.bio1) has 20 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4QM7 GTP 0.00002137 0.47726 None
2 1F5N GNP 0.001049 0.45107 1.17925
3 1G7C 5GP 0.000102 0.50544 1.41509
4 3Q9T FAY 0.02561 0.40056 1.41509
5 2WKQ GTP 0.001137 0.44424 1.50602
6 2B8W ALF 5GP 0.003247 0.42559 1.52439
7 3VX3 ADP 0.00199 0.42761 1.6129
8 1Y3A GDP 0.00002451 0.51861 1.82371
9 4A4Z ANP 0.003196 0.43375 1.88679
10 3EC1 GDP 0.0004515 0.43667 1.89702
11 1BH2 GSP 0.00009918 0.50112 1.90476
12 4KBF AMP 0.0001469 0.43834 1.91781
13 4RD0 GDP 0.0001135 0.48676 1.92771
14 5KUT GDP 0.00003626 0.47983 2.1164
15 2DPY ADP 0.001041 0.46869 2.12264
16 5M04 GDP 0.00002664 0.46857 2.12264
17 5KSZ GCP 0.0005468 0.43901 2.12264
18 1OYY AGS 0.007418 0.4162 2.12264
19 2ZFI ADP 0.0005733 0.42441 2.18579
20 4R43 GDP 0.001719 0.44667 2.35849
21 5FJJ MAN 0.03746 0.40783 2.35849
22 2XTZ GSP 0.000673 0.45808 2.54237
23 1FNN ADP 0.00004512 0.49975 2.57069
24 1H65 GDP 0.001546 0.43641 2.59259
25 5GJC ATP 0.0003696 0.43284 2.59434
26 5EVY SAL 0.02044 0.40612 2.59434
27 5KSP GDP 0.0003631 0.44505 2.63158
28 4WOP CTP 0.001058 0.44173 2.66667
29 1YZG GDP 0.00001354 0.49529 2.7933
30 4AG5 ADP 0.0000556 0.53855 2.80612
31 1XTQ GDP 0.0001024 0.4909 2.82486
32 2JLR ANP 0.0007875 0.43733 2.83019
33 1PUJ GNP 0.0001136 0.47296 2.83688
34 5L3W GDP 0.0002512 0.45133 2.94118
35 3COB ADP 0.00005187 0.42247 2.98103
36 1AZT GSP 0.00008808 0.50348 2.98507
37 1O3Y GTP 0.00005832 0.50181 3.01205
38 3B7G ANP 0.0001761 0.45128 3.04348
39 5MZN ADP 0.00001952 0.46302 3.06604
40 4ZG4 VO4 ADP 0.001111 0.44469 3.06604
41 2FSH ANP 0.0002124 0.43607 3.06604
42 3FC4 EDO 0.03697 0.40484 3.06604
43 1TAD GDP 0.0001651 0.49101 3.08642
44 1TAD ALF 0.0001651 0.49101 3.08642
45 3FYH ADP 0.00301 0.42707 3.10559
46 5EP2 AZU 0.0003854 0.46109 3.125
47 1RE0 GDP 0.00001209 0.4777 3.16742
48 1SVM ATP 0.00287 0.45381 3.18302
49 2C78 GNP 0.0001715 0.47881 3.20988
50 2C77 GNP 0.0002087 0.47284 3.20988
51 3AB3 GDP 0.00009359 0.48822 3.25203
52 3T5G GDP 0.00008804 0.46961 3.28947
53 1X6V ADP 0.002402 0.43782 3.30189
54 4B47 GDP 0.00001735 0.5501 3.30579
55 2BVN GNP 0.00006339 0.48327 3.30789
56 1D8T GDP 0.00005228 0.46308 3.30789
57 1WF3 GNP 0.0002414 0.47999 3.32226
58 2OG2 MLI 0.0000002253 0.41347 3.34262
59 2I4I AMP 0.0003613 0.4578 3.35731
60 2WIC GNP 0.00003599 0.47986 3.37079
61 2WOJ ADP ALF 0.001373 0.44579 3.38983
62 3ZS9 ADP ALF 0.001506 0.44396 3.38983
63 1GWN GTP 0.000691 0.4499 3.41463
64 2ZR9 DTP 0.00002174 0.47729 3.4384
65 1S9D GDP 0.00003689 0.51963 3.44828
66 5CK5 GDP 0.00001721 0.48002 3.48101
67 1D2E GDP 0.0002783 0.45588 3.52645
68 1EK0 GNP 0.0008869 0.45268 3.52941
69 4IEE AGS 0.000535 0.47692 3.53774
70 4NCN GTP 0.0003688 0.46606 3.53774
71 4YS0 ADP 0.001432 0.43173 3.53774
72 2HCJ GDP 0.00002152 0.4669 3.58209
73 3PQC GDP 0.0003563 0.44525 3.58974
74 1W0J ADP 0.0002242 0.46062 3.67647
75 1W0J ADP BEF 0.004475 0.41214 3.67647
76 1SVK ALF GDP 0.00003781 0.52208 3.68272
77 4R98 GNH 0.0004335 0.4333 3.69004
78 1NST A3P 0.004855 0.40859 3.69231
79 1ZD9 GDP 0.00004017 0.50196 3.7234
80 3SBD GNP 0.0007811 0.40407 3.74332
81 2BME GNP 0.000141 0.48869 3.76344
82 4DCT GDP 0.00006325 0.50869 3.77358
83 1M2O GNP 0.0001371 0.48924 3.77358
84 1QHG ATP 0.0001105 0.47316 3.77358
85 2ZPA ADP 0.0002301 0.46871 3.77358
86 5TSH ANP 0.00006548 0.46148 3.77358
87 3ZQ6 ADP ALF 0.001051 0.45104 3.77358
88 5TSH ADP 0.0000801 0.43266 3.77358
89 2FAH GDP 0.002578 0.41582 3.77358
90 1YZN GNP 0.0002205 0.41693 3.78378
91 2GDJ ANP 0.001193 0.41427 3.78788
92 1M7B GTP 0.0005818 0.4532 3.80435
93 4LC1 GDP 0.0001213 0.44857 3.85757
94 4FCW ADP 0.0004994 0.43613 3.85852
95 3A1S GDP 0.000181 0.45127 3.87597
96 1V8K ANP 0.0004749 0.47344 3.90244
97 3NHB ADP 0.00003183 0.439 3.92157
98 3TK1 GDP 0.00003686 0.45383 3.93939
99 4M9Q GNP 0.00006397 0.46247 3.96476
100 2GK6 ADP 0.00003778 0.45162 4.00943
101 1YQT ADP 0.00003303 0.44129 4.00943
102 5I0H ADP BEF 0.001266 0.43829 4.00943
103 4WZA ACP 0.009612 0.43678 4.00943
104 4WZA ADP 0.01034 0.4352 4.00943
105 1FP6 ADP 0.003347 0.4105 4.00943
106 1Q8A HCS 0.02196 0.40439 4.00943
107 2HT6 GDP 0.000009768 0.48101 4.02299
108 2C04 GCP 0.000428 0.45459 4.0404
109 5LB3 ADP 0.001285 0.40595 4.04494
110 3DKP ADP 0.0003478 0.43337 4.08163
111 2J5V PCA 0.03072 0.40603 4.08719
112 3REF GDP 0.0003415 0.4344 4.12371
113 1NY5 ADP 0.00005811 0.49239 4.13437
114 4NU0 AP5 0.0008472 0.46959 4.14747
115 4GOX A3P 0.001127 0.44441 4.15335
116 2CJW GDP 0.00002233 0.53704 4.16667
117 3DEF GDP 0.0006667 0.44019 4.19847
118 2XTN GTP 0.00123 0.44271 4.2735
119 1T5C ADP 0.00007311 0.40689 4.29799
120 5L3V GDP 0.0001296 0.46305 4.34783
121 1TQ4 GDP 0.0001111 0.48494 4.35835
122 5L3S GNP 0.0002398 0.47639 4.36242
123 1RYH GNP 0.0001979 0.45534 4.4335
124 1XKV ATP 0.0001322 0.46446 4.48113
125 1IN4 ADP 0.000002194 0.55734 4.49102
126 4U5X GNP 0.0003985 0.45825 4.49438
127 2G77 GDP 0.0001981 0.46917 4.54545
128 1ZIN AP5 0.0002887 0.49415 4.60829
129 4MKF AP5 0.001204 0.46586 4.60829
130 4MKG AP5 0.001336 0.46259 4.60829
131 1W5T ANP 0.000252 0.46924 4.61165
132 1W5T ADP 0.001035 0.43788 4.61165
133 4NON GDP 0.00006707 0.50707 4.61538
134 1SVI GDP 0.0001424 0.44073 4.61538
135 3DC4 ADP 0.0001094 0.43325 4.65116
136 1I4D GDP 0.0001472 0.44001 4.6875
137 2IS6 ADP 0.00003395 0.47341 4.71698
138 2J0V GDP 0.0001654 0.45062 4.71698
139 4PFO ADP 0.001143 0.44771 4.71698
140 1U8Z GDP 0.0005855 0.4571 4.7619
141 4PX9 ADP 0.001538 0.40237 4.79452
142 4P32 ADP 0.001574 0.43606 4.81928
143 1MH1 GNP 0.000327 0.47402 4.83871
144 3ZFD ANP 0.000365 0.44487 4.8433
145 2BCG GDP 0.0002456 0.45634 4.85437
146 1SQ5 ADP 0.0004821 0.46748 4.87013
147 1G4U GDP 0.0004505 0.44539 4.8913
148 3W5J GDP 0.00002764 0.43663 4.90196
149 1OS1 PYR 0.002081 0.44213 4.95283
150 1OS1 ATP 0.001934 0.44213 4.95283
151 2XAU ADP 0.0009854 0.42625 4.95283
152 2GCO GNP 0.0004568 0.45336 4.97512
153 2GCN GDP 0.00269 0.42572 4.97512
154 1JJ7 ADP 0.000002878 0.61685 5
155 1JI0 ATP 0.00002956 0.54677 5
156 1Z0F GDP 0.00003819 0.47774 5.02793
157 2FJU GSP 0.000651 0.45104 5.05618
158 1OXV ANP 0.00006888 0.44967 5.09915
159 2ZE7 DST 0.005059 0.42008 5.13834
160 2VVG ADP 0.00006999 0.40711 5.14286
161 2IXE ATP 0.001346 0.43908 5.16605
162 3BFV ADP 0.001069 0.41319 5.16605
163 1G16 GDP 0.0008281 0.44845 5.29412
164 3QKT ANP 0.003302 0.42527 5.30973
165 2WJG GDP 0.0001042 0.45475 5.31915
166 4U00 ADP 0.000001855 0.44821 5.32787
167 1YRB GDP 0.00008898 0.47767 5.34351
168 1ZJ6 G3D 0.00001538 0.53738 5.34759
169 5HCN GCP 0.00003212 0.48003 5.36398
170 3CX8 GSP 0.00006046 0.51095 5.41872
171 2BIF ANP 0.0006453 0.46989 5.42453
172 2BIF SIN 0.001278 0.46678 5.42453
173 1SKQ GDP 0.00004306 0.45866 5.42453
174 3TBK ANP 0.0008396 0.40712 5.42453
175 1KMQ GNP 0.000869 0.44945 5.43478
176 1G6H ADP 0.000003558 0.44088 5.44747
177 4WZ6 ATP 0.0003624 0.49574 5.51724
178 5N69 ADP 0.001533 0.425 5.52764
179 3FB4 AP5 0.001049 0.46757 5.55556
180 1X1R GDP 0.000693 0.45924 5.61798
181 1U0J ADP 0.0002218 0.43435 5.61798
182 3B9Q MLI 0.000001108 0.41677 5.62914
183 1TX4 ALF GDP 0.001062 0.40971 5.64972
184 1Z6T ADP 0.0004639 0.45307 5.66038
185 2GMV UN8 0.003225 0.43049 5.66038
186 2GMV PEP 0.003887 0.42966 5.66038
187 1NHX FTB 0.008154 0.42914 5.66038
188 1NHX PEP 0.008117 0.4283 5.66038
189 4IOK ADP 0.03844 0.40597 5.66038
190 1M7G ADX 0.000586 0.46894 5.6872
191 1M7G ADP 0.0005825 0.46597 5.6872
192 1M7G AV2 0.0001119 0.44193 5.6872
193 1DS6 GDP 0.0001308 0.44776 5.72917
194 2HF9 GSP 0.0000539 0.50752 5.75221
195 1JJV ATP 0.0001255 0.43097 5.82524
196 1UPT GTP 0.0001575 0.48045 5.84795
197 4K81 GTP 0.0003699 0.47332 5.84795
198 1GP2 GDP 0.00006357 0.45804 5.88235
199 1G7S GDP 0.0001133 0.49687 5.89226
200 1P72 ADP 0.001107 0.45762 5.89623
201 1YTM ATP 0.0008071 0.4289 5.89623
202 2WHX ADP 0.00018 0.41837 5.89623
203 4D0N GDP 0.0000755 0.45726 5.89812
204 1GOJ ADP 0.00005419 0.41044 5.91549
205 1HE1 GDP 0.0004687 0.43676 5.92593
206 2WJH GDP 0.00005349 0.4737 6.0241
207 2WJH FLC 0.0000882 0.47037 6.0241
208 2Y65 ADP 0.0000728 0.41975 6.0274
209 1R4A GNP 0.00007371 0.49937 6.06061
210 1MR3 G3D 0.000008638 0.50196 6.07735
211 2XT3 ADP 0.0000213 0.4375 6.10465
212 5FG3 GDP 0.00003924 0.45971 6.13208
213 1BG2 ADP 0.00005112 0.40995 6.15385
214 1OIX GDP 0.0001645 0.48567 6.28272
215 1OIV GDP 0.0003519 0.47078 6.28272
216 1F9V ADP 0.0000761 0.43025 6.34006
217 3FWY ADP 0.00471 0.40916 6.36943
218 1S3G AP5 0.0007444 0.47464 6.45161
219 2W2X GSP 0.0004443 0.45836 6.45161
220 2Q2Y ADP 0.006367 0.43038 6.53951
221 2Q2Y MKR 0.007091 0.42711 6.53951
222 5WRJ A3P 0.009891 0.40223 6.60066
223 1MKY GDP 0.00001448 0.48293 6.60377
224 1FZQ GDP 0.000008692 0.494 6.62983
225 3WXM GTP 0.0006256 0.45951 6.64894
226 4YMU ATP 0.00005246 0.45485 6.66667
227 3FVQ ATP 0.003797 0.41722 6.68524
228 2RCN GDP 0.00001263 0.48687 6.70391
229 3E70 GDP 0.00004132 0.47488 6.70732
230 2OFW ADX 0.001893 0.45428 6.73077
231 2RGX AP5 0.0001533 0.50968 6.79612
232 1L2T ATP 0.001658 0.4387 6.80851
233 2VF7 ADP 0.000216 0.44825 6.83962
234 2IYL GDP 0.0001546 0.44781 6.83962
235 2QEN ADP 0.00001938 0.51316 6.85714
236 1NRJ GTP 0.00001436 0.52414 6.88073
237 1UKZ ADP 0.002135 0.44573 6.89655
238 3A4M ADP 0.00004178 0.4486 6.92308
239 3TMK T5A 0.0007657 0.46054 6.94444
240 5L3R GCP 0.0001844 0.43384 6.97674
241 2GJ8 ALF GDP 0.000227 0.41613 6.97674
242 3IUY AMP 0.0002511 0.43877 7.01754
243 1NF3 GNP 0.0004801 0.4647 7.03125
244 2ZEJ GDP 0.0003596 0.47215 7.06522
245 1KK1 GNP 0.0000486 0.45659 7.07317
246 1CS4 GSP 0.00006926 0.42917 7.07547
247 2CHG ANP 0.00006311 0.49082 7.07965
248 1YVD GNP 0.00009598 0.49622 7.10059
249 5H56 TYD 0.0004707 0.47179 7.17949
250 5H56 ADP 0.0004707 0.47179 7.17949
251 3Q72 GNP 0.00003705 0.46232 7.22892
252 3P4X ADP 0.00006086 0.45342 7.26392
253 2A5F GTP 0.00007593 0.4988 7.31132
254 1N4W FAD 0.01934 0.41189 7.31132
255 2BEK ATP 0.003881 0.43841 7.393
256 2F9L GDP 0.0004287 0.42545 7.53769
257 1Z06 GNP 0.0001096 0.49164 7.54717
258 1JWY GDP 0.0001817 0.46453 7.54717
259 1IHU AF3 0.001795 0.43353 7.54717
260 1IHU ADP 0.001974 0.43353 7.54717
261 1JWY ADP 0.002309 0.40579 7.54717
262 2AWN ADP 0.0000008114 0.44094 7.61155
263 1B7T ADP 0.004317 0.41869 7.69231
264 5HPY GDP 0.001019 0.43818 7.75862
265 1KK8 BEF ADP 0.00257 0.42065 7.79221
266 3B5J 12D 0.000174 0.5079 7.81893
267 1ION ADP 0.003926 0.40268 7.81893
268 2PEZ DAT 0.001374 0.45328 7.82123
269 2PEZ GGZ 0.001374 0.45328 7.82123
270 3BOS CDP 0.0001046 0.4546 7.85124
271 1OW3 GDP 0.001059 0.43744 7.85124
272 3DZD ADP 0.00003241 0.49799 7.88043
273 1E96 GTP 0.000736 0.45633 7.88177
274 1DAR GDP 0.00005012 0.46422 8.01887
275 2QG6 NMN 0.0003828 0.47264 8.0402
276 2A9K GDP 0.0003947 0.45613 8.07175
277 3RWO GDP 0.0003449 0.47117 8.10811
278 2V7Q ATP 0.0001327 0.46341 8.21918
279 2CK3 ADP 0.003583 0.42197 8.21918
280 2CK3 ANP 0.004832 0.41068 8.21918
281 2V7Q ADP 0.001899 0.40663 8.21918
282 1R2Q GNP 0.0001995 0.49504 8.23529
283 1QF9 C5P 0.003866 0.43735 8.24742
284 1QF9 ADP 0.003866 0.43735 8.24742
285 1QF9 ALF 0.003866 0.43735 8.24742
286 4LPS GDP 0.00004175 0.47769 8.26446
287 3BER AMP 0.00008226 0.45709 8.43373
288 4PJ3 ANP 0.000129 0.47137 8.49057
289 3ZIA ADP 0.0001273 0.47128 8.49057
290 3ZIA ATP 0.0001092 0.46074 8.49057
291 1KSH GDP 0.000043 0.50312 8.60215
292 1Z0K GTP 0.00009352 0.44936 8.69565
293 5HTX ADP 0.01074 0.40846 8.72641
294 3MJH GTP 0.00009982 0.43265 8.82353
295 1Z2A GDP 0.0004165 0.4267 8.92857
296 3RLF ANP 0.001822 0.43509 8.94737
297 4BAS GNP 0.0005049 0.45799 9.04523
298 3T1O GDP 0.0001837 0.45804 9.09091
299 4XTR ATP 0.001586 0.43779 9.13043
300 4XVU ATP 0.001586 0.43778 9.13043
301 4XTR ADP 0.003271 0.41812 9.13043
302 3IIJ ADP 0.00001814 0.48158 9.44444
303 4ZNL BEF ADP 0.0006125 0.43169 9.48905
304 1FQK GDP 0.0001486 0.44216 9.52381
305 5X40 ACP 0.002107 0.43227 9.58904
306 1LVG ADP 0.00003571 0.45227 9.59596
307 1NJF ADP 0.000001638 0.56291 9.6
308 1NJF AGS 0.000007052 0.54032 9.6
309 1S8F GDP 0.01752 0.42309 9.60452
310 5UWP GNP 0.0000999 0.4992 9.70464
311 5DIF GNP 0.00009605 0.49813 9.70464
312 5UWW GNP 0.00009909 0.49751 9.70464
313 5DHF GNP 0.00009932 0.49747 9.70464
314 5UWU GNP 0.0001015 0.49704 9.70464
315 5UWS GNP 0.0001148 0.49646 9.70464
316 5UWI GNP 0.000108 0.49582 9.70464
317 5UWT GNP 0.0001125 0.49502 9.70464
318 5UWR GNP 0.000115 0.49458 9.70464
319 5DI9 GNP 0.0001367 0.493 9.70464
320 5UWH GNP 0.00008349 0.43365 9.70464
321 5UWO GNP 0.000102 0.43085 9.70464
322 5UWQ GNP 0.0001124 0.42962 9.70464
323 5UWJ GNP 0.0001252 0.4281 9.70464
324 3BC1 GNP 0.0001569 0.4866 9.74359
325 4TMK T5A 0.002995 0.43889 9.85915
326 2A5J GDP 0.0000894 0.49554 9.94764
327 1Z08 GNP 0.00004449 0.50706 10
328 3RAB GNP 0.0001565 0.48665 10.0592
329 1Z0J GTP 0.0001438 0.49018 10.1695
330 4TTQ ATP 0.0007303 0.42117 10.2326
331 5TAR GDP 0.0001298 0.48252 10.2703
332 5TB5 GDP 0.00008572 0.47066 10.2703
333 3GJ7 GDP 0.00004552 0.52222 10.4072
334 3GJ0 GDP 0.00005662 0.51768 10.4072
335 3GJ8 GDP 0.00004922 0.47332 10.4072
336 3GJ3 GDP 0.00003349 0.47219 10.4072
337 1CXZ GSP 0.0007695 0.44986 10.4651
338 2UZI GTP 0.000348 0.471 10.5769
339 1VG8 GNP 0.00008936 0.49955 10.628
340 1VG0 GDP 0.0001427 0.46897 10.628
341 4HAT GNP 0.0001085 0.49756 10.6481
342 1IBR GNP 0.0001114 0.49521 10.6481
343 5BXQ GDP 0.00004487 0.47476 10.6481
344 1KAO GDP 0.0004029 0.45574 10.7784
345 4DID GDP 0.0001801 0.44975 10.8808
346 3QBT GNP 0.0004133 0.41008 10.9195
347 1G3Q ADP 0.002838 0.43149 10.9705
348 1A4R GDP 0.0003419 0.46117 10.9948
349 1A4R GNH 0.0004212 0.4549 10.9948
350 4ITR GDP 0.0005296 0.45283 10.9948
351 2NGR GDP 0.0001962 0.44789 10.9948
352 1GRN GDP 0.0007598 0.44373 10.9948
353 4HSE ADP 0.00003023 0.48255 11.335
354 1LFD GNP 0.0003823 0.46916 11.3772
355 1TU3 GNP 0.0001614 0.48604 11.3924
356 1NVU GTP 0.0003381 0.47337 11.4458
357 1NVV GNP 0.0003726 0.47145 11.4458
358 3DDC GNP 0.0004776 0.46657 11.4458
359 1WQ1 GDP 0.002576 0.42837 11.4458
360 4HI0 GDP 0.00006802 0.49433 11.5578
361 4DSU GDP 0.0003624 0.472 11.6402
362 5UQW GDP 0.0003889 0.46697 11.6402
363 3GJ5 GDP 0.0000537 0.47191 11.7647
364 1R6B ADP 0.0001657 0.45451 11.7925
365 3H4S ADP 0.00005657 0.42081 11.7925
366 4FRZ ADP 0.0001415 0.42075 11.7925
367 3Q85 GNP 0.00002613 0.47348 11.8343
368 2PL3 ADP 0.0001321 0.50677 11.8644
369 1VG9 GDP 0.00003039 0.48049 11.8919
370 1VG1 GDP 0.00003543 0.47793 11.8919
371 2D7C GTP 0.0001975 0.48209 11.9048
372 4HDO GNP 0.0004584 0.46737 11.976
373 1Z0A GDP 0.0000436 0.48314 12.069
374 1F2U ATP 0.004995 0.42033 12.1622
375 4LJ9 ACP 0.001482 0.41231 12.2642
376 3M1I GTP 0.0001213 0.49353 12.3288
377 4V0K GDP 0.00003251 0.45696 12.426
378 3T12 GDP ALF 0.000328 0.4663 12.5
379 4Q1A 2XZ 0.01146 0.4638 12.5
380 4Q1A UDP 0.01146 0.4638 12.5
381 2C5L GTP 0.0004038 0.46987 12.8205
382 5XCO GDP 0.0001928 0.46305 12.8655
383 5O2T GSP 0.0003486 0.41108 13.0178
384 4OI4 ATP 0.0009223 0.44829 13.0435
385 1WA5 GTP 0.00009902 0.40949 13.0682
386 5UFQ GNP 0.0002092 0.48097 13.1148
387 3KTA AP5 0.002193 0.41807 13.1868
388 4KFU ACP 0.000205 0.41761 13.6792
389 1KY3 GDP 0.0002766 0.45629 13.7363
390 5BQ5 ADP BEF 0.00005002 0.50704 13.7566
391 1CLU DBG 0.000678 0.47886 13.8554
392 2KIN ADP 0.00003671 0.41346 14
393 2FFQ GSP 0.0002674 0.47798 14.0351
394 2HV8 GTP 0.0001217 0.49158 14.0625
395 2VB6 ADP BEF 0.0009054 0.44865 14.094
396 1YZQ GNP 0.0001573 0.48843 14.1176
397 1D5C GDP 0.0002853 0.46227 14.1975
398 3LL5 IP8 0.01418 0.4133 14.4578
399 2CE7 ADP 0.000084 0.51548 14.6226
400 1VHT BA3 0.0006924 0.43228 14.6789
401 1D2N ANP 0.0001556 0.47848 14.7059
402 4J56 FAD 0.03424 0.4006 14.9123
403 2FH5 GTP 0.00003555 0.50677 14.9533
404 1Z83 AP5 0.00368 0.43473 15.3061
405 2ODE ALF GDP 0.00009577 0.50182 15.7143
406 4H1V GNP 0.0002773 0.46281 15.7182
407 4QOS ADP 0.00003807 0.51245 15.8491
408 2QN6 GDP 0.00002402 0.54315 16.129
409 1FQJ GDP 0.0001228 0.48738 16.6667
410 1KO8 6PG 0.00007611 0.48979 17.1429
411 2W58 ADP 0.000002867 0.45272 17.3267
412 1ZC3 GNP 0.0002383 0.48025 17.7143
413 3GJ4 GDP 0.00004156 0.46895 18.1818
414 4CVN ADP 0.0000598 0.53132 18.9781
415 3HU3 AGS 0.003466 0.48998 19.1038
416 1F6B GDP 0.000007248 0.50578 19.1919
417 4BQS K2Q 0.0003113 0.48741 19.3182
418 4BQS ADP 0.0003113 0.48741 19.3182
419 3KUD GDP 0.0004533 0.45798 19.7531
420 1GUA GNP 0.000488 0.40594 19.7531
421 5HR5 ADP 0.0005788 0.44888 19.8113
422 3QF7 ANP 0.002557 0.42283 20
423 4C4P GNP 0.0001292 0.49229 20.5607
424 1ZUI SKM 0.0003921 0.48272 22.0238
425 3H86 AP5 0.001229 0.45821 22.3958
426 2QTV GNP 0.00005404 0.50542 22.449
427 1QHH ATP 0.00003605 0.5201 22.7545
428 5KDO GDP 0.00004498 0.47887 22.973
429 1GOT GDP 0.00005179 0.50188 23.2877
430 3UIE ANP 0.0002253 0.45278 24.5
431 4D81 ADP 0.0000002897 0.58366 26.1484
432 2QZ4 ADP 0.000000212 0.58041 26.3359
433 1J2J GTP 0.0000611 0.45632 26.6667
434 2OM2 GDP 0.00005107 0.47655 27.7778
435 2D7D ADP 0.000327 0.43373 35
Pocket No.: 3; Query (leader) PDB : 4XGU; Ligand: ADP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 4xgu.bio2) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 4XGU; Ligand: ADP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 4xgu.bio2) has 20 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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