-->
Receptor
PDB id Resolution Class Description Source Keywords
2GQR 2 Å EC: 6.3.2.6 SAICAR SYNTHETASE COMPLEXED WITH ADP-MG2+ ESCHERICHIA COLI PURC ADE2 ADE1 NUCLEOTIDE COMPLEX OCTAHEDRAL MAGNESIUM COORDINATION ALTERNATE FOLDING LIGASE
Ref.: NUCLEOTIDE COMPLEXES OF ESCHERICHIA COLI PHOSPHORIBOSYLAMINOIMIDAZOLE SUCCINOCARBOXAMIDE SYNTHETASE. J.BIOL.CHEM. V. 281 20680 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:238;
B:238;
Valid;
Valid;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
MG A:239;
B:239;
Invalid;
Invalid;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2GQR 2 Å EC: 6.3.2.6 SAICAR SYNTHETASE COMPLEXED WITH ADP-MG2+ ESCHERICHIA COLI PURC ADE2 ADE1 NUCLEOTIDE COMPLEX OCTAHEDRAL MAGNESIUM COORDINATION ALTERNATE FOLDING LIGASE
Ref.: NUCLEOTIDE COMPLEXES OF ESCHERICHIA COLI PHOSPHORIBOSYLAMINOIMIDAZOLE SUCCINOCARBOXAMIDE SYNTHETASE. J.BIOL.CHEM. V. 281 20680 2006
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2GQR - 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 4 families.
1 2GQR - 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 3 families.
1 2GQR - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP; Similar ligands found: 452
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 HEJ 0.9 1
3 ATP 0.9 1
4 A2D 0.895522 0.971831
5 5FA 0.887324 1
6 AQP 0.887324 1
7 AP5 0.884058 0.971831
8 B4P 0.884058 0.971831
9 BA3 0.869565 0.971831
10 AN2 0.84507 0.985915
11 AT4 0.84507 0.958904
12 M33 0.833333 0.958333
13 ACQ 0.826667 0.972222
14 A 0.823529 0.971429
15 AMP 0.823529 0.971429
16 ACP 0.821918 0.972222
17 6YZ 0.818182 0.972222
18 APR 0.810811 0.971831
19 AR6 0.810811 0.971831
20 ANP 0.802632 0.972222
21 SAP 0.8 0.945946
22 AGS 0.8 0.945946
23 AD9 0.8 0.972222
24 ADX 0.783784 0.873418
25 CA0 0.783784 0.945205
26 TAT 0.779221 0.958904
27 T99 0.779221 0.958904
28 50T 0.773333 0.958333
29 ABM 0.763889 0.917808
30 APC 0.763158 0.958904
31 PRX 0.763158 0.893333
32 ATF 0.759494 0.958904
33 A22 0.753086 0.985915
34 AP2 0.743243 0.958904
35 A12 0.743243 0.958904
36 SRA 0.736111 0.918919
37 ADQ 0.73494 0.945205
38 25L 0.732558 0.985915
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 A3R 0.714286 0.907895
44 ATR 0.708861 0.971429
45 ADP PO3 0.708861 0.943662
46 PAP 0.708861 0.985714
47 SRP 0.707317 0.906667
48 7D3 0.706667 0.905405
49 25A 0.702381 0.971831
50 9X8 0.697674 0.92
51 OAD 0.697674 0.945205
52 RBY 0.6875 0.932432
53 ADV 0.6875 0.932432
54 00A 0.686047 0.883117
55 OOB 0.682353 0.931507
56 5SV 0.682353 0.848101
57 8QN 0.682353 0.931507
58 3OD 0.681818 0.945205
59 BIS 0.681818 0.933333
60 ALF ADP 0.674699 0.87013
61 ADP ALF 0.674699 0.87013
62 AMO 0.674419 0.932432
63 4AD 0.674419 0.92
64 PAJ 0.674419 0.884615
65 GAP 0.670732 0.893333
66 MAP 0.670588 0.945946
67 AHX 0.666667 0.896104
68 VO4 ADP 0.666667 0.931507
69 DLL 0.666667 0.931507
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 LMS 0.653333 0.82716
75 LAD 0.651685 0.860759
76 WAQ 0.651685 0.883117
77 B5V 0.651685 0.906667
78 PR8 0.651685 0.85
79 ITT 0.65 0.943662
80 7D4 0.65 0.905405
81 G5P 0.648936 0.921053
82 XYA 0.647059 0.84507
83 ADN 0.647059 0.84507
84 RAB 0.647059 0.84507
85 1ZZ 0.644444 0.839506
86 ME8 0.644444 0.839506
87 FYA 0.644444 0.905405
88 NB8 0.644444 0.896104
89 TXA 0.644444 0.932432
90 6AD 0.642857 0.909091
91 ADP BMA 0.640449 0.918919
92 G3A 0.638298 0.921053
93 DAL AMP 0.632184 0.905405
94 AFH 0.631579 0.884615
95 9SN 0.630435 0.871795
96 9ZA 0.625 0.907895
97 DQV 0.625 0.958333
98 9ZD 0.625 0.907895
99 GTA 0.625 0.886076
100 YAP 0.623656 0.894737
101 B5M 0.623656 0.894737
102 FA5 0.623656 0.906667
103 B5Y 0.623656 0.894737
104 UP5 0.622449 0.92
105 HFD 0.619048 0.945946
106 XAH 0.617021 0.839506
107 AV2 0.616279 0.917808
108 AOC 0.615385 0.821918
109 48N 0.612245 0.896104
110 4UV 0.610526 0.894737
111 6V0 0.606061 0.896104
112 NAI 0.606061 0.907895
113 DND 0.606061 0.932432
114 NAX 0.606061 0.873418
115 NXX 0.606061 0.932432
116 TXD 0.606061 0.907895
117 5N5 0.605634 0.819444
118 5AS 0.604938 0.77907
119 A4P 0.60396 0.843373
120 DAT 0.60241 0.905405
121 A2R 0.602273 0.985915
122 TXE 0.6 0.907895
123 OMR 0.6 0.851852
124 4UU 0.597938 0.894737
125 GA7 0.597938 0.906667
126 A A 0.597826 0.944444
127 A4D 0.597222 0.819444
128 5CD 0.597222 0.805556
129 AP0 0.594059 0.896104
130 4TC 0.594059 0.896104
131 A3P 0.592593 0.971429
132 T5A 0.592233 0.841463
133 139 0.592233 0.873418
134 7D5 0.592105 0.878378
135 ATP A A A 0.589474 0.930556
136 LAQ 0.585859 0.839506
137 MYR AMP 0.585106 0.817073
138 F2R 0.580952 0.864198
139 YLP 0.58 0.819277
140 UPA 0.578431 0.907895
141 7DD 0.578313 0.985714
142 3AM 0.576923 0.929577
143 ADJ 0.576923 0.851852
144 COD 0.575472 0.811765
145 NAD 0.575472 0.931507
146 3AT 0.574713 0.971831
147 JB6 0.574468 0.883117
148 4UW 0.574257 0.860759
149 EP4 0.573333 0.753247
150 A2P 0.573171 0.957143
151 CNA 0.571429 0.932432
152 TYM 0.568627 0.906667
153 PPS 0.568182 0.873418
154 DTA 0.565789 0.786667
155 M2T 0.565789 0.734177
156 AR6 AR6 0.565657 0.917808
157 A3D 0.564815 0.918919
158 80F 0.564815 0.841463
159 3DH 0.564103 0.773333
160 G5A 0.563218 0.77907
161 YLB 0.563107 0.819277
162 YLC 0.563107 0.839506
163 AMP DBH 0.561224 0.893333
164 TYR AMP 0.561224 0.87013
165 MTA 0.558442 0.773333
166 DTP 0.556818 0.905405
167 AHZ 0.554455 0.817073
168 NA7 0.553191 0.958904
169 IOT 0.552381 0.831325
170 ZAS 0.55 0.766234
171 7MD 0.55 0.8625
172 ARG AMP 0.55 0.829268
173 IMO 0.548781 0.929577
174 YLA 0.54717 0.819277
175 NAE 0.544643 0.894737
176 TAD 0.544554 0.884615
177 A5A 0.544444 0.807229
178 2AM 0.544304 0.943662
179 TSB 0.543478 0.819277
180 6RE 0.54321 0.759494
181 AYB 0.542056 0.809524
182 NAQ 0.539823 0.871795
183 V3L 0.539326 0.971831
184 SSA 0.538462 0.8
185 AF3 ADP 3PG 0.538462 0.8375
186 ZID 0.535088 0.918919
187 LPA AMP 0.533981 0.817073
188 52H 0.532609 0.77907
189 VMS 0.532609 0.788235
190 54H 0.532609 0.788235
191 BTX 0.53211 0.841463
192 A3N 0.53012 0.786667
193 J7C 0.53012 0.769231
194 5X8 0.528736 0.763158
195 BT5 0.527273 0.831325
196 8X1 0.526882 0.752809
197 5CA 0.526882 0.8
198 53H 0.526882 0.77907
199 ARU 0.526316 0.860759
200 EAD 0.525862 0.873418
201 RGT 0.525253 0.958904
202 OVE 0.52439 0.905405
203 S4M 0.52381 0.666667
204 7DT 0.522727 0.985714
205 GDP 0.522222 0.92
206 DDS 0.522222 0.878378
207 AVV 0.521277 0.896104
208 NDE 0.521008 0.932432
209 7MC 0.518868 0.841463
210 DSH 0.518072 0.725
211 MAO 0.517647 0.759036
212 NSS 0.515789 0.8
213 DSZ 0.515789 0.8
214 LSS 0.515789 0.761364
215 P5A 0.515464 0.744444
216 DZD 0.513514 0.884615
217 NVA LMS 0.510417 0.752809
218 9K8 0.510204 0.714286
219 12D 0.509615 0.785714
220 M24 0.508772 0.85
221 YLY 0.508772 0.809524
222 P1H 0.508333 0.851852
223 5AD 0.506849 0.746479
224 GJV 0.505882 0.75
225 LEU LMS 0.505155 0.752809
226 AMP NAD 0.504505 0.905405
227 4TA 0.504505 0.807229
228 G A A A 0.504505 0.871795
229 NAJ PZO 0.504425 0.848101
230 GSU 0.5 0.77907
231 128 0.5 0.776471
232 KAA 0.5 0.752809
233 71V 0.5 0.907895
234 A3G 0.5 0.8
235 NDC 0.5 0.871795
236 7D7 0.5 0.743243
237 N0B 0.495726 0.819277
238 NJP 0.495495 0.945946
239 ODP 0.495495 0.909091
240 2SA 0.494624 0.932432
241 6C6 0.494505 0.881579
242 SFG 0.494382 0.75
243 0WD 0.491071 0.921053
244 YSA 0.490196 0.77907
245 PO4 PO4 A A A A PO4 0.489796 0.902778
246 SAM 0.48913 0.690476
247 6IA 0.48913 0.8375
248 A7D 0.488636 0.776316
249 6FA 0.488 0.841463
250 FB0 0.487805 0.804598
251 NAJ PYZ 0.487179 0.807229
252 A5D 0.483516 0.786667
253 IDP 0.483516 0.918919
254 SA8 0.483516 0.707317
255 PGS 0.483146 0.883117
256 MHZ 0.483146 0.697674
257 DA 0.482353 0.878378
258 D5M 0.482353 0.878378
259 NEC 0.482353 0.746667
260 NIA 0.481928 0.822785
261 Y3J 0.480519 0.726027
262 8PZ 0.480392 0.8
263 FAD 0.480315 0.851852
264 FAS 0.480315 0.851852
265 FDA 0.48 0.833333
266 N6P 0.479592 0.915493
267 GGZ 0.479167 0.825
268 U A 0.478261 0.907895
269 SAH 0.478261 0.74359
270 SAI 0.478261 0.734177
271 A G 0.477876 0.883117
272 NPW 0.477477 0.886076
273 NDP 0.477477 0.921053
274 AAM 0.476744 0.971429
275 C2R 0.47561 0.90411
276 AMZ 0.47561 0.916667
277 A A A 0.474747 0.905405
278 GTP 0.473684 0.92
279 U A G G 0.473684 0.883117
280 SMM 0.473684 0.686047
281 NZQ 0.473214 0.909091
282 TXP 0.473214 0.921053
283 A3S 0.47191 0.810811
284 SFD 0.46875 0.734043
285 AIR 0.468354 0.901408
286 AAT 0.468085 0.707317
287 EEM 0.468085 0.690476
288 J7V 0.466667 0.833333
289 Z5A 0.466667 0.77907
290 7C5 0.466667 0.818182
291 62F 0.465649 0.8625
292 HDV 0.463158 0.893333
293 FAY 0.462121 0.8625
294 A3T 0.461538 0.821918
295 ETB 0.461538 0.833333
296 DCA 0.461538 0.823529
297 A6D 0.46 0.722892
298 A U 0.459459 0.87013
299 GEK 0.459184 0.7375
300 6K6 0.459184 0.930556
301 RFL 0.458647 0.821429
302 NAP 0.458333 0.945205
303 S7M 0.458333 0.690476
304 4YB 0.457944 0.761364
305 WSA 0.454545 0.788235
306 TAP 0.454545 0.907895
307 FNK 0.454545 0.804598
308 COA 0.453782 0.823529
309 0T1 0.453782 0.823529
310 101 0.453488 0.878378
311 XNP 0.452174 0.873418
312 NA0 0.45082 0.932432
313 7RP 0.448276 0.928571
314 GP3 0.446809 0.921053
315 TM1 0.446602 0.77381
316 APU 0.446429 0.894737
317 PUA 0.445378 0.884615
318 V1N 0.443396 0.917808
319 7RA 0.443182 0.957747
320 COS 0.442623 0.804598
321 AMX 0.442623 0.833333
322 30N 0.442623 0.752688
323 CAO 0.442623 0.795455
324 QQY 0.44186 0.815789
325 ACK 0.44186 0.861111
326 649 0.441441 0.744444
327 0UM 0.44 0.698795
328 NHD 0.439655 0.905405
329 CMX 0.439024 0.823529
330 SCO 0.439024 0.823529
331 GCP 0.438776 0.896104
332 8BR 0.438202 0.906667
333 GNH 0.4375 0.907895
334 8Q2 0.4375 0.772727
335 3AD 0.4375 0.805556
336 NVA 2AD 0.43617 0.759494
337 62X 0.435644 0.666667
338 FCX 0.435484 0.795455
339 ACO 0.435484 0.795455
340 FAM 0.435484 0.804598
341 9JJ 0.434783 0.8625
342 GNP 0.434343 0.896104
343 9GM 0.434343 0.896104
344 NMX 0.433071 0.76087
345 MGP 0.43299 0.884615
346 26A 0.432099 0.763158
347 HAX 0.432 0.804598
348 K15 0.431373 0.682353
349 DG1 0.430894 0.921053
350 1DG 0.430894 0.921053
351 QQX 0.430233 0.805195
352 2VA 0.430108 0.8
353 S8M 0.43 0.759494
354 2MC 0.429688 0.769231
355 6G0 0.428571 0.884615
356 P5F 0.428571 0.823529
357 FYN 0.428571 0.823529
358 3KK 0.428571 0.804598
359 A C A C 0.428571 0.848101
360 7L1 0.427419 0.795455
361 FAI 0.426966 0.916667
362 RMB 0.426966 0.873239
363 AS 0.426966 0.833333
364 1RB 0.425287 0.885714
365 CA6 0.425197 0.729167
366 SOP 0.425197 0.804598
367 OXK 0.425197 0.804598
368 MCD 0.425197 0.804598
369 COK 0.425197 0.804598
370 G1R 0.424242 0.907895
371 SXZ 0.423077 0.710843
372 CC5 0.423077 0.816901
373 F2N 0.422535 0.813953
374 EO7 0.422222 0.788235
375 ANZ 0.422018 0.8
376 1VU 0.421875 0.795455
377 CMC 0.421875 0.804598
378 CO6 0.421875 0.804598
379 ZDA 0.421053 0.864865
380 GKE 0.420561 0.884615
381 GDC 0.420561 0.884615
382 GDD 0.420561 0.884615
383 NFD 0.420168 0.883117
384 GSP 0.42 0.873418
385 D3Y 0.42 0.789474
386 MC4 0.419847 0.76087
387 3D1 0.419753 0.773333
388 3L1 0.419753 0.773333
389 FA9 0.41958 0.864198
390 5GP 0.419355 0.906667
391 G 0.419355 0.906667
392 KB1 0.419048 0.698795
393 CAJ 0.418605 0.804598
394 SCD 0.418605 0.823529
395 CMP 0.417582 0.901408
396 2BA 0.417582 0.915493
397 SO8 0.416667 0.789474
398 VRT 0.416667 0.769231
399 N01 0.416667 0.905405
400 IVC 0.415385 0.813953
401 1HE 0.415385 0.786517
402 A1S 0.415385 0.804598
403 BCO 0.415385 0.804598
404 3HC 0.415385 0.813953
405 MLC 0.415385 0.804598
406 NMN AMP PO4 0.415254 0.87013
407 2FA 0.414634 0.813333
408 MGO 0.414141 0.860759
409 3NZ 0.413462 0.782051
410 COO 0.412214 0.804598
411 MCA 0.412214 0.795455
412 YE1 0.412214 0.813953
413 CAA 0.412214 0.813953
414 GAV 0.411765 0.884615
415 PRT 0.411215 0.931507
416 JLN 0.411111 0.890411
417 P2P 0.411111 0.902778
418 ZZB 0.410256 0.77381
419 SP1 0.409091 0.842105
420 RP1 0.409091 0.842105
421 2CP 0.409091 0.795455
422 SCA 0.409091 0.804598
423 103 0.409091 0.837838
424 PAX 0.408 0.829268
425 FAD NBT 0.407143 0.75
426 COW 0.406015 0.795455
427 3CP 0.406015 0.804598
428 IRC 0.406015 0.813953
429 BYC 0.406015 0.804598
430 CA8 0.406015 0.729167
431 1GZ 0.406015 0.795455
432 COF 0.406015 0.786517
433 HGG 0.406015 0.804598
434 2KQ 0.406015 0.786517
435 G2P 0.405941 0.884615
436 SLU 0.404959 0.770115
437 U A C C 0.404959 0.858974
438 RBZ 0.404494 0.849315
439 1CZ 0.404412 0.795455
440 FAQ 0.402985 0.804598
441 BCA 0.402985 0.795455
442 4CA 0.402985 0.795455
443 MTP 0.402439 0.730769
444 8OD 0.402062 0.945205
445 CO7 0.401515 0.804598
446 GRA 0.4 0.804598
447 G2R 0.4 0.884615
448 ENQ 0.4 0.916667
449 CNV FAD 0.4 0.8
450 GMV 0.4 0.896104
451 HXC 0.4 0.786517
452 HF7 0.4 0.893333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2GQR; Ligand: ADP; Similar sites found with APoc: 455
This union binding pocket(no: 1) in the query (biounit: 2gqr.bio1) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 5XG5 A2G None
2 2DTJ THR None
3 6MJ7 ARG None
4 3PFG SAM None
5 3PFG TLO None
6 3F5O UOC COA None
7 2BS5 BGC GAL FUC None
8 3ZW0 FUC None
9 1KNM LAT None
10 4OWK NGA None
11 3ORK AGS 0.843882
12 1GSA ADP 0.843882
13 4EWH T77 0.843882
14 4E1Z 0MX 1.26582
15 5CEO 50D 1.26582
16 3PG7 PTY 1.26582
17 5CJF 520 1.26582
18 1GU3 BGC BGC BGC BGC BGC 1.34228
19 5OO5 UUA 1.6129
20 5MW8 ATP 1.68776
21 2Z7R STU 1.68776
22 5E2N V14 1.68776
23 2ZV2 609 1.68776
24 5UR1 YY9 1.68776
25 3DLS ADP 1.68776
26 2PVF ACP 2.1097
27 3V8S 0HD 2.1097
28 3JU6 ANP 2.1097
29 2HGS ADP 2.1097
30 3TM0 ANP 2.1097
31 3TM0 B31 2.1097
32 3VPD ANP 2.1097
33 5EO8 TFU 2.1097
34 4GN8 ASO 2.1097
35 5X8I SQZ 2.1097
36 3KAL ADP 2.1097
37 4GNC ASO 2.1097
38 4COQ SAN 2.1097
39 3RI1 3RH 2.1097
40 5H2U 1N1 2.1097
41 4G31 0WH 2.1097
42 1Y7P RIP 2.24215
43 5JSP DQY 2.48756
44 2BMB PMM 2.53165
45 3X01 AMP 2.53165
46 5JZJ AN2 2.53165
47 2PZI AXX 2.53165
48 1TMM HHR 2.53165
49 1TMM APC 2.53165
50 2R5T ANP 2.53165
51 1DMY AZM 2.53165
52 5A6N U7E 2.53165
53 5LPB ADP 2.53165
54 5W4W 9WG 2.53165
55 1OFZ FUC 2.53165
56 3MVH WFE 2.53165
57 5LPZ ADP 2.53165
58 2WU6 DKI 2.53165
59 2XOC ADP 2.53165
60 5T9C G3P 2.53165
61 4GJ3 0XP 2.53165
62 4DFU QUE 2.53165
63 4EUU BX7 2.53165
64 4KBA 1QM 2.53165
65 5C4L 4XR 2.53165
66 2D24 XYS XYS 2.53165
67 4AT3 LTI 2.53165
68 5OKT 9XK 2.53165
69 5W6Y TRP 2.53165
70 5C4L SIS 2.53165
71 3LXN MI1 2.53165
72 3UIM ANP 2.53165
73 4OH4 ANP 2.53165
74 4IDT T28 2.53165
75 2X2M X2M 2.53165
76 5V1B 8UY 2.53165
77 6GZD LCI 2.53165
78 4O4F IHP 2.53165
79 4O4F ATP 2.53165
80 5C1P ADP 2.53165
81 4LO2 GAL BGC 2.72109
82 2OVD DAO 2.74725
83 3AB4 THR 2.80899
84 6FL8 ADP 2.95359
85 6FL8 TIY 2.95359
86 3UDZ ADP 2.95359
87 4KS7 X4Z 2.95359
88 4XH0 ADP 2.95359
89 2PVN P63 2.95359
90 5HVJ ANP 2.95359
91 4D4U FUC NDG GAL FUC 2.95359
92 5EW9 5VC 2.95359
93 2IO8 ADP 2.95359
94 4QTB 38Z 2.95359
95 3FW3 ETS 2.95359
96 3WVR AMP 2.95359
97 6C0T EE4 2.95359
98 3E5A VX6 2.95359
99 5KO1 6UY 2.95359
100 3BZ3 YAM 2.95359
101 5MUA GAL 2.95359
102 5JKG 6LF 2.95359
103 4K38 SAM 2.95359
104 3ETH ATP 2.95359
105 3TFC PEP 2.95359
106 5USZ SKE 2.95359
107 2B9H ADP 2.95359
108 1JPA ANP 2.95359
109 2B9I ADP 2.95359
110 4NZN 2OU 2.95359
111 4NZN ANP 2.95359
112 2B9F ADP 2.95359
113 4USF 6UI 2.95359
114 4PU5 ANP 2.95359
115 2XVD AS6 2.95359
116 4G17 0VN 2.95359
117 2QZS 250 2.95359
118 2QZS GLC 2.95359
119 2QZS ADP 2.95359
120 4ASE AV9 2.95359
121 2BKK ADP 2.95858
122 4IZY 1J2 2.98103
123 2IF8 ADP 3.0303
124 2GJ5 VD3 3.08642
125 5ETR 5RW 3.10559
126 5ETR APC 3.10559
127 4L4J NAG NAG BMA MAN NAG 3.16742
128 3E2M E2M 3.24324
129 5D48 L96 3.28947
130 5DRB 5FJ 3.37553
131 2VPQ ANP 3.37553
132 4WB6 ATP 3.37553
133 2YAK OSV 3.37553
134 5DEY 59T 3.37553
135 4CLI 5P8 3.37553
136 2WQN ADP 3.37553
137 4WNK 453 3.37553
138 6A1G 9OL 3.37553
139 2XK9 XK9 3.37553
140 4O1P ANP 3.37553
141 2GU8 796 3.37553
142 4OCV ANP 3.37553
143 5I35 ANP 3.37553
144 1RE8 BD2 3.37553
145 4WB7 ATP 3.37553
146 3EKK GS2 3.37553
147 4YZN 4K5 3.37553
148 4OCJ NDG 3.37553
149 2Q7D ANP 3.37553
150 4GYI ADP 3.37553
151 1IR3 ANP 3.37553
152 1UNB AKG 3.37553
153 4OAV ACP 3.37553
154 1UNB PN1 3.37553
155 5N87 N66 3.37553
156 1K3A ACP 3.37553
157 3D91 REM 3.37553
158 4WUP 3UF 3.37553
159 3NW7 LGV 3.37553
160 3K5X P8D 3.37553
161 2XMY CDK 3.37553
162 1I7L ATP 3.37553
163 5EEH P9P 3.37553
164 4M26 AKG 3.37553
165 4AG8 AXI 3.37553
166 3RGA LSB 3.37553
167 4K33 ACP 3.69231
168 2AGC DAO 3.7037
169 5IXH OTP 3.72671
170 5XVG 8FX 3.79747
171 2VN9 GVD 3.79747
172 6C7Y ADP 3.79747
173 4OPC PGT 3.79747
174 4OPC FDA 3.79747
175 4A4X JUP 3.79747
176 4YZC STU 3.79747
177 3PLS ANP 3.79747
178 1PHK ATP 3.79747
179 2YAB AMP 3.79747
180 4QMN DB8 3.79747
181 4Y8D 49J 3.79747
182 5IM3 DTP 3.79747
183 2FB3 MET 3.79747
184 5EFQ ADP 3.79747
185 3C0G 3AM 3.79747
186 2R7K ACP 3.79747
187 2R7K AMZ 3.79747
188 2VZ6 FEF 3.79747
189 1OLM VTQ 3.79747
190 2FB3 GTP 3.79747
191 3FHR P4O 3.79747
192 4XF6 ADP 3.79747
193 2WEL K88 3.79747
194 5Y80 IRE 3.79747
195 5LXM ADP 3.79747
196 4XF6 INS 3.79747
197 4XF6 LIP 3.79747
198 4CYI ATP 3.79747
199 2V7O DRN 3.79747
200 2FB3 5AD 3.79747
201 3SXS PP2 3.79747
202 4RYV ZEA 3.87097
203 4XZ3 ACP 3.91304
204 4XYM A12 3.91304
205 2ET1 GLV 3.9801
206 4QM9 CYS 4.04624
207 3PVW QRX 4.05405
208 5LI1 ANP 4.21941
209 3RWP ABQ 4.21941
210 5LI9 ACP 4.21941
211 5GZ9 ANP 4.21941
212 2JLD AG1 4.21941
213 3VPB ADP 4.21941
214 1O9U ADZ 4.21941
215 5LVP ATP 4.21941
216 4DC2 ADE 4.21941
217 1Q8Y ADP 4.21941
218 4E93 GUI 4.21941
219 3M2W L8I 4.21941
220 4XCB AKG 4.21941
221 1Q8Y ADE 4.21941
222 4N70 2HX 4.21941
223 4NM5 ADP 4.21941
224 3FC2 IBI 4.21941
225 3ZRM ZRM 4.21941
226 1AUX AGS 4.21941
227 5WO4 B7V 4.21941
228 5TA6 79D 4.21941
229 3VPC ADP 4.21941
230 3V4S ATP 4.21941
231 4TQK NAG 4.21941
232 4IX4 ADP 4.21941
233 1PK8 ATP 4.21941
234 3AKK ADP 4.21941
235 5VC5 96M 4.21941
236 4G7A AZM 4.21941
237 3ALN ANP 4.21941
238 3V4S ADP 4.21941
239 2HW1 FRU 4.21941
240 4JR7 GNP 4.21941
241 1UNH IXM 4.21941
242 3F7Z 34O 4.21941
243 1EB1 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 4.21941
244 5L8L ADP 4.2735
245 3IDB ANP 4.34783
246 1QIN GIP 4.37158
247 4GO7 THR 4.5
248 2P7Q GG6 4.51128
249 3SCH TB6 4.54545
250 1ZZ7 S0H 4.54545
251 2Y7P SAL 4.58716
252 1KJ1 MAN 4.58716
253 5K2M ADP 4.64135
254 5IH9 6BF 4.64135
255 2JDR L20 4.64135
256 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 4.64135
257 3TXO 07U 4.64135
258 2QK4 ATP 4.64135
259 4OUJ LBT 4.64135
260 4WHZ 3NL 4.64135
261 3W0O ADP 4.64135
262 3W0O HY0 4.64135
263 4YMJ 4EJ 4.64135
264 6AC9 ANP 4.64135
265 5AWM ANP 4.64135
266 3TTI KBI 4.64135
267 4UX9 ANP 4.64135
268 6B9T 2HE 4.64135
269 5T8O 76Z 4.64135
270 2CM4 RCL 4.66667
271 3SRV S19 4.69314
272 4X5S AZM 4.74138
273 4CS9 AMP 4.7619
274 5UKL SIX 4.83871
275 4MNS 2AX 5.03145
276 6BXI ANP 5.06329
277 3KRL KRL 5.06329
278 1U5R ATP 5.06329
279 3E7O 35F 5.06329
280 3TII ANP 5.06329
281 6E2O S0L 5.06329
282 4BHN BH9 5.06329
283 1VJY 460 5.06329
284 3ORQ ADP 5.06329
285 2YW2 ATP 5.06329
286 4MA6 28E 5.09554
287 1Y9Q MED 5.20833
288 6E8I PTR 5.32544
289 3A6T 8OG 5.42636
290 4BFM ANP 5.48523
291 2PUL ACP 5.48523
292 2BPM 529 5.48523
293 4PNI KQQ 5.48523
294 4RFM 3P6 5.48523
295 5EOB 5QQ 5.48523
296 6GIN IR2 5.48523
297 3BGD PM6 5.48523
298 4CFU 2WC 5.48523
299 4BCQ TJF 5.48523
300 4L9I 8PR 5.48523
301 2F57 23D 5.48523
302 3FHI ANP 5.84416
303 2QCS ANP 5.90717
304 4FL3 ANP 5.90717
305 6F3G CJN 5.90717
306 4FG8 ATP 5.90717
307 5EQY 5RA 5.90717
308 4YRY NAD 5.90717
309 5LXT ACP 5.90717
310 4LH7 1X8 5.90717
311 4WW8 VD9 5.90717
312 2ZYI STE 5.90717
313 5OES ADP 5.90717
314 4YRY FAD 5.90717
315 5YF9 NIO 5.90717
316 3KMW ATP 5.90717
317 6FYV 3NG 5.90717
318 3FSY SCA 5.90717
319 2ZL7 FUC GAL NGA 5.90717
320 4F9C 0SX 5.90717
321 5UIU 8CG 5.90717
322 1N8V BDD 6.25
323 2A19 ANP 6.28571
324 3PE2 E1B 6.32911
325 3E8N VRA 6.32911
326 3E8N ATP 6.32911
327 3TDV GDP 6.32911
328 2VQD AP2 6.32911
329 3Q60 ATP 6.32911
330 5DBX ANP 6.32911
331 3SLS ANP 6.32911
332 4PZ6 GMP 6.32911
333 5BVE 4VG 6.32911
334 3IGO ANP 6.32911
335 4CC6 L5Y 6.32911
336 1XJD STU 6.32911
337 5OMY 9YE 6.32911
338 4EN4 ATP 6.32911
339 4EN4 GT0 6.32911
340 4EN4 GT1 6.32911
341 1YRO UDP 6.50407
342 2CSN CKI 6.75105
343 3DAK ANP 6.75105
344 3VOT ADP 6.75105
345 1M0W ANP 6.75105
346 3WO0 ADP 6.75105
347 3WO0 ALA 6.75105
348 5FPN KYD 6.75105
349 4H3Q ANP 6.75105
350 6FYL 3NG 6.75105
351 3BEO UD1 6.75105
352 4NST ADP 6.75105
353 5LN8 GAL 6.87023
354 4XBA 5GP 7
355 2PYW ADP 7.173
356 4Y0X ADP 7.173
357 1TZD ADP 7.173
358 1IOW PHY 7.173
359 1IOW ADP 7.173
360 2F2U M77 7.173
361 3PN1 IVH 7.173
362 4MV1 ADP 7.173
363 4WW7 AMP 7.173
364 2AQX ATP 7.173
365 1EU1 MGD 7.173
366 3G5D 1N1 7.173
367 5HIP 61O 7.26073
368 1IA9 ANP 7.59494
369 5M06 ADP 7.59494
370 4M69 ANP 7.59494
371 3GC0 AMP 7.59494
372 2GPT TLA 7.59494
373 6CQF F97 7.59494
374 3GQI ACP 7.9646
375 2V58 LZJ 8.01688
376 3TKI S25 8.01688
377 6CGD GNP 8.01688
378 6CGD AKN 8.01688
379 3LXK MI1 8.01688
380 4NW6 2NS 8.01688
381 2HY0 306 8.01688
382 5JCA FAD 8.01688
383 3NBC LAT 8.10811
384 2QX0 PH2 8.1761
385 5F90 LMR 8.33333
386 5F90 GLA GAL BGC 5VQ 8.33333
387 5F90 GLA GAL 8.33333
388 3HAV ATP 8.43882
389 1T36 ADP 8.43882
390 1ZP9 ATP 8.43882
391 3RE4 TO1 8.43882
392 2QLU ADE 8.43882
393 1ZTH ADP 8.43882
394 6D61 4AA 8.71795
395 2YG2 FLC 8.72093
396 2YG2 S1P 8.72093
397 5VLQ ANP 8.86076
398 4OTH DRN 8.86076
399 4C2V YJA 8.86076
400 4C2W ANP 8.86076
401 5EYK 5U5 8.86076
402 4CRL C1I 8.86076
403 3I0O ADP 8.86076
404 5Y86 HRM 9.2827
405 4OYA 1VE 9.2827
406 4WNP 3RJ 9.2827
407 1TQP ATP 9.70464
408 2RIO ADP 9.70464
409 5HQ0 LZ9 9.70464
410 5VCV 1N1 9.70464
411 3WXL ADP 9.70464
412 6GU6 1QK 9.70464
413 5OLK DTP 9.70464
414 1ZY5 ANP 9.70464
415 1ZHX HC3 9.70464
416 5C03 AGS 9.70464
417 5DMZ ADP 10.1266
418 5FBN 5WF 10.1266
419 5MY8 RXZ 10.1266
420 4Y93 746 10.1266
421 4UXL 5P8 10.1266
422 5DZT AMP 10.1266
423 1S68 AMP 10.1266
424 2QL9 CIT 10.4046
425 5HCY 60D 10.5485
426 1Z2P ACP 10.5485
427 1Z2P I3S 10.5485
428 3VSV XYS 10.5485
429 3VRY B43 10.5485
430 2HK5 1BM 10.5485
431 2DT9 THR 10.7784
432 4IJP 1EH 10.9705
433 1W2D 4IP 11.3924
434 1W2D ADP 11.3924
435 2GOO NDG 11.4504
436 5TBM 79A 11.9658
437 2ZQO NGA 12.3077
438 4ZS4 ATP 12.6582
439 3PDT ADP 12.6582
440 5G1X ADP 12.6984
441 4ZGR NGA GAL 13.0802
442 5VNF VAL THR SER VAL VAL 13.0802
443 4NJH SAM 13.5021
444 4NJH 2K8 13.5021
445 5YK1 ANP 13.9241
446 4LRJ ANP 14.2012
447 4Q5H ANP 15.7895
448 1CBK ROI 16.25
449 5UPK ANP 16.6667
450 4L3L 5FI 16.8776
451 5ZCT ANP 16.8776
452 3KN5 ANP 20.2532
453 3LQV ADE 28.2051
454 4H3P ANP 29.1667
455 5ODT ADP 39.1304
Pocket No.: 2; Query (leader) PDB : 2GQR; Ligand: ADP; Similar sites found with APoc: 89
This union binding pocket(no: 2) in the query (biounit: 2gqr.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
1 4K55 H6P None
2 2E56 MYR None
3 6F7X MFU None
4 3ZW2 NAG GAL FUC None
5 5JGA 6KC 1.68776
6 5JFS 6K0 1.68776
7 1NB9 RBF 2.04082
8 1NB9 ADP 2.04082
9 3DLG GWE 2.1097
10 1TIW FAD 2.1097
11 1TIW TFB 2.1097
12 3AJH BL3 2.1097
13 6CZ3 FLJ 2.1097
14 5EKO N17 2.53165
15 4BTK DTQ 2.53165
16 6MPT C30 2.53165
17 4V24 GYR 2.53165
18 4CSD MFU 2.53165
19 4NFN 2KC 2.53165
20 1SGJ OAA 2.53165
21 5DH3 5BS 2.53165
22 6G9I CXX 2.95359
23 4K37 SAM 2.95359
24 4K39 SAM 2.95359
25 2B9J ADP 2.95359
26 4XV1 904 2.95359
27 5EXW 7DT 2.95359
28 2WA4 069 3.37553
29 4LOO SB4 3.37553
30 5NJI 8Z2 3.37553
31 5NM7 GLY 3.37553
32 4P5Z Q7M 3.37553
33 5EEH SAH 3.37553
34 1CM8 ANP 3.37553
35 4U0I 0LI 3.37553
36 3BU5 ATP 3.37553
37 6D6L FY4 3.52941
38 4NFE BEN 3.79747
39 6FE1 V14 3.79747
40 4I94 ANP 3.79747
41 5TO8 7FM 3.79747
42 5HV7 RBL 3.79747
43 5HZX 2GE 3.97727
44 3CY2 MB9 4.21941
45 4XCB HY0 4.21941
46 6H3O FAD 4.21941
47 3AY6 NAI 4.21941
48 2GC0 PAN 4.25532
49 1WUB OTP 4.49438
50 4D52 GIV 4.64135
51 5WL1 D3D 4.64135
52 5WL1 CUY 4.64135
53 6GNF QPS 4.64135
54 4AZW ATP 4.64135
55 5TDF ADP 5.06329
56 5VSM 5AD 5.06329
57 5VSM MET 5.06329
58 3C1X CKK 5.06329
59 5GUD NDP 5.06329
60 5GUD 2IT 5.06329
61 6G34 5ID 5.48523
62 4BS0 6NT 5.90717
63 4ITH RCM 5.90717
64 3OZ2 OZ2 5.90717
65 4ZU4 4TG 6.08108
66 1P6O HPY 6.21118
67 3H4L ANP 6.32911
68 5IH1 GDP 6.32911
69 5IH1 6BQ 6.32911
70 5VZ0 ADP 6.32911
71 3GC8 B45 6.32911
72 3MTX PGT 6.62252
73 4UAL 3FV 6.75105
74 4JX1 CAH 6.75105
75 1UYY BGC BGC 6.87023
76 3GNI ATP 7.173
77 3HZT J60 7.59494
78 3PP0 03Q 7.59494
79 3VQ2 LP4 LP5 MYR DAO 7.63889
80 4U44 3D9 8.01688
81 2Y88 2ER 8.01688
82 5AX9 4KT 8.01688
83 5W0N UPU 8.01688
84 4RFR RHN 8.37438
85 4YGF AZM 8.54701
86 5WNL STU 8.86076
87 1T27 PCW 8.86076
88 5EH0 5NW 13.5021
89 4P25 FUC GAL NAG FUC 15.6118
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