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Receptor
PDB id Resolution Class Description Source Keywords
3V4S 2.02 Å EC: 4.1.1.21 CRYSTAL STRUCTURE OF ADP-ATP COMPLEX OF PURK: N5-CARBOXYAMIN RIBONUCLEOTIDE SYNTHETASE BACILLUS ANTHRACIS CARBOXYLASE PURK SYNTHASE ADP/ATP LYASE
Ref.: ELUCIDATION OF THE BICARBONATE BINDING SITE AND INS INTO THE CARBOXYLATION MECHANISM OF (N(5))-CARBOXYAMINOIMIDAZOLE RIBONUCLEOTIDE SYNTHAS FROM BACILLUS ANTHRACIS. ACTA CRYSTALLOGR.,SECT.D V. 70 3057 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP B:401;
Valid;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MG B:402;
A:402;
B:403;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
CO3 A:403;
B:404;
Invalid;
Invalid;
none;
none;
submit data
60.009 C O3 C(=O)...
ADP A:401;
Valid;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3V4S 2.02 Å EC: 4.1.1.21 CRYSTAL STRUCTURE OF ADP-ATP COMPLEX OF PURK: N5-CARBOXYAMIN RIBONUCLEOTIDE SYNTHETASE BACILLUS ANTHRACIS CARBOXYLASE PURK SYNTHASE ADP/ATP LYASE
Ref.: ELUCIDATION OF THE BICARBONATE BINDING SITE AND INS INTO THE CARBOXYLATION MECHANISM OF (N(5))-CARBOXYAMINOIMIDAZOLE RIBONUCLEOTIDE SYNTHAS FROM BACILLUS ANTHRACIS. ACTA CRYSTALLOGR.,SECT.D V. 70 3057 2014
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 4DLK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3V4S - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 4DLK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3V4S - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4DLK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3V4S - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 3ORQ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ATP; Similar ligands found: 422
No: Ligand ECFP6 Tc MDL keys Tc
1 HEJ 1 1
2 ATP 1 1
3 5FA 0.985507 1
4 AQP 0.985507 1
5 AP5 0.927536 0.971831
6 B4P 0.927536 0.971831
7 BA3 0.913043 0.971831
8 ADP 0.9 1
9 A2D 0.884058 0.971831
10 AGS 0.84 0.945946
11 SAP 0.84 0.945946
12 6YZ 0.833333 0.972222
13 AT4 0.810811 0.958904
14 AN2 0.810811 0.985915
15 25L 0.809524 0.985915
16 AR6 0.802632 0.971831
17 APR 0.802632 0.971831
18 M33 0.8 0.958333
19 ACQ 0.794872 0.972222
20 TAT 0.794872 0.958904
21 T99 0.794872 0.958904
22 AD9 0.792208 0.972222
23 ACP 0.789474 0.972222
24 AMP 0.788732 0.971429
25 A 0.788732 0.971429
26 ANP 0.772152 0.972222
27 CA0 0.753247 0.945205
28 ADX 0.753247 0.873418
29 A22 0.746988 0.985915
30 50T 0.74359 0.958333
31 PRX 0.734177 0.893333
32 APC 0.734177 0.958904
33 ABM 0.733333 0.917808
34 ATF 0.731707 0.958904
35 ITT 0.730769 0.943662
36 7D4 0.730769 0.905405
37 ADQ 0.729412 0.945205
38 A3R 0.729412 0.907895
39 AP2 0.714286 0.958904
40 A12 0.714286 0.958904
41 A1R 0.709302 0.907895
42 SRA 0.706667 0.918919
43 5AL 0.698795 0.931507
44 HFD 0.695122 0.945946
45 9X8 0.693182 0.92
46 OAD 0.693182 0.945205
47 AU1 0.6875 0.972222
48 SRP 0.682353 0.906667
49 G5P 0.680851 0.921053
50 25A 0.678161 0.971831
51 3OD 0.677778 0.945205
52 4AD 0.670455 0.92
53 G3A 0.670213 0.921053
54 00A 0.662921 0.883117
55 RBY 0.662651 0.932432
56 ADP PO3 0.662651 0.943662
57 ADV 0.662651 0.932432
58 BIS 0.659341 0.933333
59 8QN 0.659091 0.931507
60 5SV 0.659091 0.848101
61 OOB 0.659091 0.931507
62 GTA 0.65625 0.886076
63 UP5 0.653061 0.92
64 AMO 0.651685 0.932432
65 PAJ 0.651685 0.884615
66 2A5 0.650602 0.918919
67 MAP 0.647727 0.945946
68 3AT 0.647059 0.971831
69 AHX 0.644444 0.896104
70 DLL 0.644444 0.931507
71 ATR 0.642857 0.971429
72 PAP 0.642857 0.985714
73 PTJ 0.641304 0.896104
74 7D3 0.6375 0.905405
75 3UK 0.637363 0.918919
76 SON 0.634146 0.932432
77 A4P 0.633663 0.843373
78 ALF ADP 0.632184 0.87013
79 ADP ALF 0.632184 0.87013
80 PR8 0.630435 0.85
81 WAQ 0.630435 0.883117
82 LAD 0.630435 0.860759
83 B5V 0.630435 0.906667
84 AFH 0.628866 0.884615
85 LMS 0.628205 0.82716
86 GAP 0.627907 0.893333
87 DTP 0.627907 0.905405
88 VO4 ADP 0.625 0.931507
89 ADP VO4 0.625 0.931507
90 TXA 0.623656 0.932432
91 ME8 0.623656 0.839506
92 1ZZ 0.623656 0.839506
93 NB8 0.623656 0.896104
94 FYA 0.623656 0.905405
95 DQV 0.622449 0.958333
96 T5A 0.621359 0.841463
97 ADN 0.619718 0.84507
98 RAB 0.619718 0.84507
99 XYA 0.619718 0.84507
100 DAL AMP 0.611111 0.905405
101 9SN 0.610526 0.871795
102 48N 0.61 0.896104
103 AP0 0.607843 0.896104
104 9ZD 0.604396 0.907895
105 9ZA 0.604396 0.907895
106 FA5 0.604167 0.906667
107 B5M 0.604167 0.894737
108 YAP 0.604167 0.894737
109 B5Y 0.604167 0.894737
110 NAI 0.60396 0.907895
111 6V0 0.60396 0.896104
112 TXD 0.60396 0.907895
113 DND 0.60396 0.932432
114 NXX 0.60396 0.932432
115 NAX 0.60396 0.873418
116 ADP BMA 0.602151 0.918919
117 A2R 0.6 0.985915
118 OMR 0.598039 0.851852
119 TXE 0.598039 0.907895
120 XAH 0.597938 0.839506
121 7DT 0.593023 0.985714
122 AOC 0.592593 0.821918
123 4UV 0.591837 0.894737
124 DDS 0.590909 0.878378
125 139 0.590476 0.873418
126 CNA 0.584906 0.932432
127 6AD 0.58427 0.909091
128 5AS 0.583333 0.77907
129 5N5 0.581081 0.819444
130 GA7 0.58 0.906667
131 4UU 0.58 0.894737
132 4TC 0.576923 0.896104
133 ADJ 0.575472 0.851852
134 5CD 0.573333 0.805556
135 A4D 0.573333 0.819444
136 RGT 0.571429 0.958904
137 A3P 0.571429 0.971429
138 7D5 0.56962 0.878378
139 LAQ 0.568627 0.839506
140 F2R 0.564815 0.864198
141 80F 0.563636 0.841463
142 YLP 0.563107 0.819277
143 A A 0.5625 0.944444
144 UPA 0.561905 0.907895
145 AV2 0.56044 0.917808
146 COD 0.559633 0.811765
147 4UW 0.557692 0.860759
148 JB6 0.556701 0.883117
149 3AM 0.555556 0.929577
150 ATP A A A 0.555556 0.930556
151 A2P 0.552941 0.957143
152 TYM 0.552381 0.906667
153 NA7 0.552083 0.958904
154 EP4 0.551282 0.753247
155 MYR AMP 0.55102 0.817073
156 PPS 0.549451 0.873418
157 YLC 0.54717 0.839506
158 YLB 0.54717 0.819277
159 NAD 0.545455 0.931507
160 DAT 0.545455 0.905405
161 TYR AMP 0.544554 0.87013
162 G5A 0.544444 0.77907
163 M2T 0.544304 0.734177
164 DTA 0.544304 0.786667
165 3DH 0.54321 0.773333
166 128 0.542857 0.776471
167 AHZ 0.538462 0.817073
168 GTP 0.537634 0.92
169 SSA 0.537634 0.8
170 MTA 0.5375 0.773333
171 IOT 0.537037 0.831325
172 A3D 0.535714 0.918919
173 ARG AMP 0.533981 0.829268
174 7MD 0.533981 0.8625
175 AR6 AR6 0.533981 0.917808
176 YLA 0.53211 0.819277
177 AMP DBH 0.529412 0.893333
178 IMO 0.529412 0.929577
179 TAD 0.528846 0.884615
180 AYB 0.527273 0.809524
181 A5A 0.526882 0.807229
182 HDV 0.526882 0.893333
183 TSB 0.526316 0.819277
184 EAD 0.525424 0.873418
185 2AM 0.52439 0.943662
186 6RE 0.52381 0.759494
187 7DD 0.522727 0.985714
188 V3L 0.521739 0.971831
189 AVV 0.520833 0.896104
190 BTX 0.517857 0.841463
191 NAE 0.517241 0.894737
192 52H 0.515789 0.77907
193 54H 0.515789 0.788235
194 VMS 0.515789 0.788235
195 NSS 0.515464 0.8
196 BT5 0.513274 0.831325
197 NAQ 0.512821 0.871795
198 ZAS 0.511905 0.766234
199 J7C 0.511628 0.769231
200 A3N 0.511628 0.786667
201 5X8 0.511111 0.763158
202 53H 0.510417 0.77907
203 8X1 0.510417 0.752809
204 5CA 0.510417 0.8
205 NVA LMS 0.510204 0.752809
206 ARU 0.510204 0.860759
207 AF3 ADP 3PG 0.509259 0.8375
208 ZID 0.508475 0.918919
209 P1H 0.508197 0.851852
210 OVE 0.505882 0.905405
211 S4M 0.505747 0.666667
212 LEU LMS 0.50505 0.752809
213 LPA AMP 0.504673 0.817073
214 7MC 0.504587 0.841463
215 DZD 0.5 0.884615
216 FB0 0.5 0.804598
217 MAO 0.5 0.759036
218 DSZ 0.5 0.8
219 LSS 0.5 0.761364
220 DSH 0.5 0.725
221 P5A 0.5 0.744444
222 NDE 0.495935 0.932432
223 N0B 0.495798 0.819277
224 M24 0.495726 0.85
225 YLY 0.495726 0.809524
226 NJP 0.495575 0.945946
227 9K8 0.49505 0.714286
228 MGP 0.494737 0.884615
229 6C6 0.494624 0.881579
230 NAJ PZO 0.491379 0.848101
231 0WD 0.491228 0.921053
232 6G0 0.489583 0.884615
233 GJV 0.488636 0.75
234 6FA 0.488189 0.841463
235 5AD 0.486842 0.746479
236 KAA 0.485149 0.752809
237 GSU 0.485149 0.77907
238 71V 0.483146 0.907895
239 NEC 0.482759 0.746667
240 A3G 0.482759 0.8
241 ODP 0.482456 0.909091
242 FAS 0.48062 0.851852
243 FAD 0.48062 0.851852
244 7D7 0.480519 0.743243
245 FDA 0.480315 0.833333
246 N6P 0.48 0.915493
247 2SA 0.479167 0.932432
248 GP3 0.478723 0.921053
249 4TA 0.478261 0.807229
250 SFG 0.478261 0.75
251 G A A A 0.478261 0.871795
252 AMP NAD 0.478261 0.905405
253 NPW 0.477876 0.886076
254 NDP 0.477876 0.921053
255 NDC 0.47619 0.871795
256 YSA 0.47619 0.77907
257 NAJ PYZ 0.475 0.807229
258 MGO 0.474227 0.860759
259 GDP 0.473684 0.92
260 NZQ 0.473684 0.909091
261 TXP 0.473684 0.921053
262 6IA 0.473684 0.8375
263 A7D 0.472527 0.776316
264 SFD 0.469231 0.734043
265 A5D 0.468085 0.786667
266 SA8 0.468085 0.707317
267 ZDA 0.468085 0.864865
268 12D 0.46789 0.785714
269 PGS 0.467391 0.883117
270 MHZ 0.467391 0.697674
271 8PZ 0.466667 0.8
272 62F 0.466165 0.8625
273 DA 0.465909 0.878378
274 D5M 0.465909 0.878378
275 GGZ 0.464646 0.825
276 SAH 0.463158 0.74359
277 SAI 0.463158 0.734177
278 FAY 0.462687 0.8625
279 Y3J 0.4625 0.726027
280 PO4 PO4 A A A A PO4 0.460784 0.902778
281 AAM 0.460674 0.971429
282 RFL 0.459259 0.821429
283 SMM 0.459184 0.686047
284 HF7 0.459184 0.893333
285 AMZ 0.458824 0.916667
286 C2R 0.458824 0.90411
287 SAM 0.458333 0.690476
288 A3S 0.456522 0.810811
289 FNK 0.455224 0.804598
290 U A 0.453782 0.907895
291 7C5 0.453704 0.818182
292 EEM 0.453608 0.690476
293 AAT 0.453608 0.707317
294 XNP 0.452991 0.873418
295 A G 0.452991 0.883117
296 PRT 0.45283 0.931507
297 AIR 0.451219 0.901408
298 62X 0.45098 0.666667
299 DCA 0.45 0.823529
300 ETB 0.45 0.833333
301 GSP 0.45 0.873418
302 U A G G 0.449153 0.883117
303 NIA 0.448276 0.822785
304 A3T 0.446809 0.821918
305 A A A 0.446602 0.905405
306 K15 0.446602 0.682353
307 PUA 0.446281 0.884615
308 6K6 0.445545 0.930556
309 GEK 0.445545 0.7375
310 4YB 0.445455 0.761364
311 S7M 0.444444 0.690476
312 Z5A 0.443548 0.77907
313 1DG 0.443548 0.921053
314 DG1 0.443548 0.921053
315 0T1 0.442623 0.823529
316 COA 0.442623 0.823529
317 WSA 0.442478 0.788235
318 8BR 0.43956 0.906667
319 8Q2 0.438596 0.772727
320 101 0.438202 0.878378
321 IDP 0.4375 0.918919
322 NVA 2AD 0.4375 0.759494
323 9JJ 0.435714 0.8625
324 NAP 0.435484 0.945205
325 APU 0.434783 0.894737
326 A U 0.434783 0.87013
327 7RP 0.433333 0.928571
328 A6D 0.432692 0.722892
329 AMX 0.432 0.833333
330 J7V 0.432 0.833333
331 TAP 0.432 0.907895
332 COS 0.432 0.804598
333 CAO 0.432 0.795455
334 30N 0.432 0.752688
335 V1N 0.431193 0.917808
336 649 0.429825 0.744444
337 P5F 0.429577 0.823529
338 NA0 0.428571 0.932432
339 SCO 0.428571 0.823529
340 CMX 0.428571 0.823529
341 7RA 0.428571 0.957747
342 0UM 0.427184 0.698795
343 GAV 0.427184 0.884615
344 QQY 0.426966 0.815789
345 1RB 0.426966 0.885714
346 ACK 0.426966 0.861111
347 G1R 0.425743 0.907895
348 GCP 0.425743 0.896104
349 FAM 0.425197 0.804598
350 FCX 0.425197 0.795455
351 ACO 0.425197 0.795455
352 GNH 0.424242 0.907895
353 F2N 0.423611 0.813953
354 GKE 0.422018 0.884615
355 GDD 0.422018 0.884615
356 GDC 0.422018 0.884615
357 HAX 0.421875 0.804598
358 3AD 0.421687 0.805556
359 9GM 0.421569 0.896104
360 GNP 0.421569 0.896104
361 FA9 0.42069 0.864198
362 TM1 0.420561 0.77381
363 KB1 0.420561 0.698795
364 H6Y 0.42 0.945205
365 2MC 0.419847 0.769231
366 3KK 0.418605 0.804598
367 FYN 0.418605 0.823529
368 S8M 0.417476 0.759494
369 7L1 0.417323 0.795455
370 2VA 0.416667 0.8
371 26A 0.416667 0.763158
372 NHD 0.416667 0.905405
373 QQX 0.41573 0.805195
374 CA6 0.415385 0.729167
375 OXK 0.415385 0.804598
376 COK 0.415385 0.804598
377 SOP 0.415385 0.804598
378 MCD 0.415385 0.804598
379 YE1 0.413534 0.813953
380 RMB 0.413043 0.873239
381 FAI 0.413043 0.916667
382 AS 0.413043 0.833333
383 CO6 0.412214 0.804598
384 1VU 0.412214 0.795455
385 CMC 0.412214 0.804598
386 NMX 0.412214 0.76087
387 SXZ 0.411215 0.710843
388 ANZ 0.410714 0.8
389 SCA 0.410448 0.804598
390 CAJ 0.409091 0.804598
391 SCD 0.409091 0.823529
392 EO7 0.408602 0.788235
393 D3Y 0.407767 0.789474
394 CC5 0.407407 0.816901
395 KH3 0.40708 0.674419
396 A C A C 0.406504 0.848101
397 SLU 0.406504 0.770115
398 G 0.40625 0.906667
399 5GP 0.40625 0.906667
400 A1S 0.406015 0.804598
401 IVC 0.406015 0.813953
402 MLC 0.406015 0.804598
403 3HC 0.406015 0.813953
404 1HE 0.406015 0.786517
405 BCO 0.406015 0.804598
406 GTG 0.405405 0.886076
407 NMN AMP PO4 0.404959 0.87013
408 3D1 0.404762 0.773333
409 3L1 0.404762 0.773333
410 2BA 0.404255 0.915493
411 CMP 0.404255 0.901408
412 VRT 0.40404 0.769231
413 SO8 0.40404 0.789474
414 MCA 0.402985 0.795455
415 COO 0.402985 0.804598
416 CAA 0.402985 0.813953
417 3NZ 0.401869 0.782051
418 G2R 0.401869 0.884615
419 ZZB 0.4 0.77381
420 2FA 0.4 0.813333
421 MC4 0.4 0.76087
422 2CP 0.4 0.795455
Ligand no: 2; 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 : 3V4S; Ligand: ATP; Similar sites found with APoc: 382
This union binding pocket(no: 1) in the query (biounit: 3v4s.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 4LNP VAL PRO PRO PRO ARG PRO PRO PRO PRO GLU None
2 5YF9 NIO 1.17994
3 2PUL ACP 1.29199
4 4PZ6 GMP 1.29199
5 2R5T ANP 1.34048
6 2Q7D ANP 1.44509
7 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 1.46199
8 2JDR L20 1.46199
9 3MVH WFE 1.46199
10 3TKI S25 1.54799
11 4DC2 ADE 1.55039
12 3DNT ATP 1.55039
13 5CKW ANP 1.55039
14 3TPV ADE 1.55039
15 5Y77 KYN 1.55039
16 4YMJ 4EJ 1.64474
17 4I94 ANP 1.66667
18 3HAV ATP 1.67224
19 4AU8 Z3R 1.68919
20 5LI1 ANP 1.69492
21 5LI9 ACP 1.71429
22 3W0O ADP 1.7192
23 3W0O HY0 1.7192
24 1V0O INR 1.73611
25 2FB3 5AD 1.76471
26 2FB3 MET 1.76471
27 2PVF ACP 1.79641
28 4CFT M48 1.80879
29 4CU1 71S 1.80879
30 3V8S 0HD 1.80879
31 2CFM AMP 1.80879
32 5OMY 9YE 1.80879
33 4CYI ATP 1.80879
34 4OAV ACP 1.80879
35 5HCY 60D 1.81269
36 4CLI 5P8 1.83486
37 5FQK 6NT 1.85874
38 4JR7 GNP 1.87166
39 5HVJ ANP 1.90476
40 3RI1 3RH 1.91693
41 5UR1 YY9 1.92926
42 2YAB AMP 1.93906
43 5I35 ANP 2.06718
44 5AE9 OKO 2.06718
45 4AZW ATP 2.06718
46 3RFA SAM 2.06718
47 3DAK ANP 2.06897
48 3PE2 E1B 2.07715
49 5DBX ANP 2.13415
50 3ALN ANP 2.14067
51 3KN5 ANP 2.15385
52 2PZI AXX 2.20264
53 5N0F 7K2 2.20994
54 4X7Q 3YR 2.24359
55 4R78 AMP 2.26537
56 3TXO 07U 2.26629
57 4ZS4 ATP 2.28013
58 1U5R ATP 2.29885
59 4XH0 ADP 2.32558
60 5Y86 HRM 2.32558
61 1Z2P ACP 2.32558
62 1Z2P I3S 2.32558
63 4UAL 3FV 2.32558
64 3PLS ANP 2.34899
65 5MY8 RXZ 2.34987
66 4NZN ANP 2.42424
67 4NZN 2OU 2.42424
68 1U59 STU 2.43902
69 5KO1 6UY 2.4735
70 6FYL 3NG 2.47934
71 6A1G 9OL 2.5
72 4IX4 ADP 2.57143
73 6C1S EFV 2.58398
74 2JLD AG1 2.58398
75 1ZY5 ANP 2.64026
76 4NM5 ADP 2.65252
77 4BTK DTQ 2.67062
78 2XOC ADP 2.68199
79 3ZRM ZRM 2.69542
80 3FSY SCA 2.71084
81 4K33 ACP 2.76923
82 4NW6 2NS 2.78638
83 2Z7R STU 2.80374
84 3PN1 IVH 2.83019
85 4CC6 L5Y 2.83019
86 5AWM ANP 2.84238
87 2PVN P63 2.84238
88 4PNI KQQ 2.84238
89 5E9G GLV 2.84238
90 1O9U ADZ 2.85714
91 4Y8D 49J 2.85714
92 3F7Z 34O 2.85714
93 4A4X JUP 2.86738
94 4OCJ NDG 2.90237
95 4GLW 0XT 2.95082
96 4IZY 1J2 2.98103
97 6BXI ANP 3.003
98 1W2D ADP 3.01887
99 1I7E IBS 3.01887
100 1W2D 4IP 3.01887
101 5W4W 9WG 3.02115
102 4KBA 1QM 3.02115
103 4UX9 ANP 3.02198
104 5UIU 8CG 3.09598
105 5MW8 ATP 3.10078
106 2BMB PMM 3.10078
107 5EXK 5AD 3.10078
108 5W75 SUC 3.10078
109 4FL3 ANP 3.10078
110 5INJ 6C7 3.10078
111 3G58 988 3.14961
112 4AG8 AXI 3.16456
113 4FG8 ATP 3.1746
114 4L9I 8PR 3.1746
115 5OKT 9XK 3.18471
116 1PNF NDG NAG 3.18471
117 3VPC ADP 3.19149
118 6FYV 3NG 3.2641
119 1OBD ATP 3.26797
120 1TZD ADP 3.27273
121 6CGD GNP 3.27869
122 6CGD AKN 3.27869
123 5WO4 B7V 3.31126
124 3O0G 3O0 3.3557
125 3X01 AMP 3.35917
126 6FL8 TIY 3.35917
127 6FL8 ADP 3.35917
128 3UDZ ADP 3.35917
129 2Z49 AMG 3.35917
130 5OLK DTP 3.35917
131 6F3G CJN 3.38983
132 2B9I ADP 3.39943
133 2B9H ADP 3.39943
134 2B9J ADP 3.39943
135 2B9F ADP 3.39943
136 4OCV ANP 3.43008
137 2YAK OSV 3.50877
138 4M69 ANP 3.51438
139 1JPA ANP 3.52564
140 5LVP ATP 3.53698
141 4LRJ ANP 3.5503
142 4RDL FUC GAL NDG FUC 3.57143
143 5ZCT ANP 3.59477
144 5MJA 7O3 3.60656
145 2PYW ADP 3.61757
146 6MJ7 ARG 3.63636
147 4WHZ 3NL 3.63636
148 1KJ1 MAN 3.66972
149 4EUU BX7 3.76176
150 1GSA ADP 3.79747
151 5TDF ADP 3.87597
152 5EQY 5RA 3.87597
153 5YK1 ANP 3.87597
154 4E1Z 0MX 3.87597
155 5A6N U7E 3.88693
156 1TQP ATP 3.90071
157 4QTB 38Z 3.94737
158 4N70 2HX 3.96341
159 5JSP DQY 3.9801
160 4Y0X ADP 4
161 4DFU QUE 4.03727
162 5DEY 59T 4.0404
163 3UPY FOM 4.04494
164 5C4L 4XR 4.04984
165 1CM8 ANP 4.08719
166 5U6C 7YS 4.12698
167 3KLL MAL 4.13437
168 3AQV TAK 4.13437
169 3IGO ANP 4.13437
170 3GNI ATP 4.13437
171 5ZTN CUR 4.13437
172 3CY2 MB9 4.14013
173 2AQX ATP 4.15225
174 2GQS ADP 4.21941
175 2GQR ADP 4.21941
176 5TO8 7FM 4.25532
177 1Q8Y ADE 4.28954
178 1Q8Y ADP 4.28954
179 4FE2 ADP 4.31373
180 3SRV S19 4.33213
181 4LH7 1X8 4.33437
182 2ZV2 609 4.36242
183 2XMY CDK 4.36242
184 5JZJ AN2 4.3771
185 5DZT AMP 4.39277
186 4GYI ADP 4.39277
187 4UWH JXM 4.39277
188 2HGS ADP 4.39277
189 4WB7 ATP 4.39277
190 4WTV ATP 4.39277
191 4F4P 0SB 4.3956
192 4OTH DRN 4.39883
193 4H3P ANP 4.41989
194 4H3Q ANP 4.41989
195 3KMW ATP 4.42804
196 5BVE 4VG 4.43213
197 1I7L ATP 4.53074
198 4L3L 5FI 4.60526
199 1XJD STU 4.63768
200 2F2U M77 4.65116
201 4PU5 ANP 4.65116
202 2X2M X2M 4.65116
203 2RIO ADP 4.65116
204 1PK8 ATP 4.73934
205 5XVG 8FX 4.77816
206 4BHN BH9 4.79042
207 1UNH IXM 4.80769
208 1RE8 BD2 4.85714
209 3GC0 AMP 4.86322
210 1EHI ADP 5.03979
211 4E93 GUI 5.03979
212 2GU8 796 5.04451
213 6CQF F97 5.05051
214 4U44 3D9 5.12048
215 4KS7 X4Z 5.13699
216 3ORK AGS 5.14469
217 3DGY 2GP 5.15464
218 6EZ6 C5Z 5.16796
219 4O1P ANP 5.16796
220 3FHI ANP 5.19481
221 3LXK MI1 5.19878
222 2V7O DRN 5.35714
223 1BYG STU 5.39568
224 6E2O S0L 5.42373
225 2IO8 ADP 5.42636
226 4CTA ATP 5.42636
227 4G17 0VN 5.45455
228 1GXU 2HP 5.49451
229 2QCS ANP 5.49828
230 4NFN 2KC 5.50162
231 2WEL K88 5.50459
232 2WU6 DKI 5.51181
233 5IDB BMA 5.6338
234 5IDB MAN 5.6338
235 2QX0 PH2 5.66038
236 4ZGP ADP 5.80205
237 3RE4 TO1 5.81395
238 1ZTH ADP 5.81395
239 1ZP9 ATP 5.81395
240 5VLQ ANP 5.94315
241 3KAL ADP 5.94315
242 4GJ3 0XP 5.96026
243 2VN9 GVD 5.98007
244 3GGF GVD 5.98007
245 4BFM ANP 5.98802
246 4OH4 ANP 6.00601
247 5LPZ ADP 6.0241
248 5N87 N66 6.07029
249 1SQL GUN 6.16438
250 5DRB 5FJ 6.18557
251 5C03 AGS 6.20155
252 5IM3 DTP 6.20155
253 3R77 QLI 6.2201
254 5USZ SKE 6.22837
255 6CMJ F6J 6.23053
256 2A19 ANP 6.28571
257 3LXN MI1 6.28931
258 6C0T EE4 6.34006
259 6GZD LCI 6.41711
260 3VSV XYS 6.45995
261 3AKK ADP 6.46154
262 1YQC GLV 6.47059
263 5COU ATP 6.47059
264 4WNP 3RJ 6.62021
265 3G5D 1N1 6.64336
266 2R7K ACP 6.6482
267 2R7K AMZ 6.6482
268 5L8L ADP 6.66667
269 1E4E ADP 6.70554
270 2VZ6 FEF 6.70927
271 5ODT ADP 6.71378
272 5LPB ADP 6.75676
273 5Y80 IRE 6.75676
274 4XV1 904 6.84932
275 3FC2 IBI 6.86567
276 3WVR AMP 6.93512
277 2WQN ADP 7.09677
278 2HK9 SKM 7.23514
279 4JLS 3ZE 7.23684
280 5HZX 2GE 7.38636
281 3EKK GS2 7.49186
282 2JKY 5GP 7.51174
283 5K2M ADP 7.54717
284 4WOV 3SM 7.57098
285 4IDT T28 7.58427
286 3TII ANP 7.63158
287 4XCP PLM 7.64706
288 3LQV ADE 7.69231
289 1AUX AGS 7.71704
290 2IF8 ADP 7.75194
291 3TDV GDP 7.84314
292 1MEX RAC 7.90698
293 3GQI ACP 7.9646
294 4WW7 AMP 8.02139
295 1S68 AMP 8.03213
296 1GU3 BGC BGC BGC BGC BGC 8.05369
297 2F57 23D 8.20189
298 5VZ0 ADP 8.26873
299 1W0J ADP 8.26873
300 4GC1 MAN MAN 8.33333
301 3TM0 B31 8.36502
302 3TM0 ANP 8.36502
303 6AC9 ANP 8.37838
304 4QMN DB8 8.3871
305 1M0W ANP 8.52713
306 3DLS ADP 8.65672
307 3HZT J60 8.78553
308 4O4F IHP 8.87097
309 4O4F ATP 8.87097
310 2BKK ADP 8.87574
311 2QK4 ATP 9.04393
312 6C7Y ADP 9.40171
313 3PVW QRX 9.45946
314 3UIM ANP 9.5092
315 6G34 5ID 9.52381
316 4OUC 5ID 9.52381
317 3C0G 3AM 9.56072
318 4U98 ACP 9.81912
319 5EFQ ADP 9.81912
320 2RIF AMP 9.92908
321 3IDB ANP 9.93789
322 6GUE FB8 10.0746
323 2BPM 529 10.1887
324 4BCM T7Z 10.3053
325 4BCN T9N 10.3053
326 4CFU 2WC 10.3053
327 4BCQ TJF 10.3053
328 4NST ADP 10.3359
329 2VPQ ANP 10.4213
330 2CSN CKI 10.4377
331 5LXT ACP 10.4895
332 5FI4 5XV 10.5943
333 5DXT 5H5 10.5943
334 6BFN DL1 10.8187
335 3M2W L8I 11.0368
336 4F9C 0SX 11.1111
337 1CBK ROI 11.25
338 5VC5 96M 11.4187
339 5IGI ZIT 11.6279
340 5IGI GMP 11.6279
341 4WNK 453 11.8863
342 3I0O ADP 12.0944
343 5UPK ANP 12.5
344 5NBW 8SK 12.6168
345 5G1X ADP 12.6984
346 1IA9 ANP 12.8571
347 1JBU BEN 12.9199
348 3VPD ANP 13.879
349 2YW2 ATP 14.2119
350 4XZ3 ACP 14.3478
351 4XYM A12 14.3478
352 5OES ADP 14.4703
353 4Q5H ANP 14.4737
354 4CS9 AMP 15.3439
355 5HQ0 LZ9 15.4762
356 6GU6 1QK 15.4762
357 6GR0 F8W 15.5172
358 6E2B PT7 15.7895
359 3MN5 LAB 15.7895
360 3WO0 ALA 16.0207
361 3WO0 ADP 16.0207
362 5M06 ADP 16.6667
363 5X8I SQZ 16.7959
364 1K3A ACP 17.0569
365 5LXM ADP 18.4211
366 4C2W ANP 19.7133
367 3E5A VX6 20.4545
368 2QF7 AGS 21.9638
369 4WB6 ATP 21.9638
370 2YRX AMP 22.9974
371 1T36 ADP 24.031
372 3VOT ADP 24.031
373 5C1P ADP 25.1634
374 5C1P DAL DAL 25.1634
375 2VQD AP2 25.431
376 1IOW ADP 28.1046
377 1IOW PHY 28.1046
378 3VPB ADP 28.5714
379 2V58 LZJ 31.2661
380 4MV1 ADP 33.5917
381 1KJ8 GAR 45.2685
382 1KJ8 ATP 45.2685
Pocket No.: 2; Query (leader) PDB : 3V4S; Ligand: ADP; Similar sites found with APoc: 281
This union binding pocket(no: 2) in the query (biounit: 3v4s.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
1 4LNP VAL PRO PRO PRO ARG PRO PRO PRO PRO GLU None
2 5YF9 NIO 1.17994
3 2PUL ACP 1.29199
4 4PZ6 GMP 1.29199
5 2R5T ANP 1.34048
6 2Q7D ANP 1.44509
7 5CKW ANP 1.55039
8 3TPV ADE 1.55039
9 3DNT ATP 1.55039
10 4DC2 ADE 1.55039
11 5XHA FRU 1.55039
12 4GQP B40 1.60643
13 4YMJ 4EJ 1.64474
14 4I94 ANP 1.66667
15 3HAV ATP 1.67224
16 4AU8 Z3R 1.68919
17 5LI9 ACP 1.71429
18 3W0O HY0 1.7192
19 3W0O ADP 1.7192
20 1V0O INR 1.73611
21 2FB3 5AD 1.76471
22 2FB3 MET 1.76471
23 2PVF ACP 1.79641
24 3V8S 0HD 1.80879
25 4CFT M48 1.80879
26 3E7S AT2 1.80879
27 5OMY 9YE 1.80879
28 4CU1 71S 1.80879
29 4JR7 GNP 1.87166
30 5HVJ ANP 1.90476
31 3RI1 3RH 1.91693
32 1FLJ GSH 1.92308
33 2YAB AMP 1.93906
34 5I35 ANP 2.06718
35 4AZW ATP 2.06718
36 3RFA SAM 2.06718
37 3DAK ANP 2.06897
38 5DBX ANP 2.13415
39 3KN5 ANP 2.15385
40 2PZI AXX 2.20264
41 5N0F 7K2 2.20994
42 4X7Q 3YR 2.24359
43 4R78 AMP 2.26537
44 3TXO 07U 2.26629
45 4ZS4 ATP 2.28013
46 1U5R ATP 2.29885
47 1Z2P I3S 2.32558
48 1Z2P ACP 2.32558
49 5Y86 HRM 2.32558
50 4XH0 ADP 2.32558
51 4UAL 3FV 2.32558
52 3PLS ANP 2.34899
53 4NZN 2OU 2.42424
54 4NZN ANP 2.42424
55 1U59 STU 2.43902
56 6A1G 9OL 2.5
57 4IX4 ADP 2.57143
58 1ZY5 ANP 2.64026
59 4NM5 ADP 2.65252
60 4BTK DTQ 2.67062
61 1V7Z CRN 2.69231
62 3ZRM ZRM 2.69542
63 4K37 SAM 2.7027
64 4K39 SAM 2.7027
65 4K33 ACP 2.76923
66 2Z7R STU 2.80374
67 4CC6 L5Y 2.83019
68 3PN1 IVH 2.83019
69 1O9U ADZ 2.85714
70 3F7Z 34O 2.85714
71 4A4X JUP 2.86738
72 4GLW 0XT 2.95082
73 4IZY 1J2 2.98103
74 1SLT NDG GAL 2.98507
75 1W2D ADP 3.01887
76 1W2D 4IP 3.01887
77 4KBA 1QM 3.02115
78 4UX9 ANP 3.02198
79 5MW8 ATP 3.10078
80 2BMB PMM 3.10078
81 5EXK 5AD 3.10078
82 5W75 SUC 3.10078
83 5JIB OIA 3.10078
84 4FG8 ATP 3.1746
85 5OKT 9XK 3.18471
86 3VPC ADP 3.19149
87 6FYV 3NG 3.2641
88 1OBD ATP 3.26797
89 1TZD ADP 3.27273
90 6AR9 3L4 3.30882
91 3O0G 3O0 3.3557
92 3X01 AMP 3.35917
93 3UDZ ADP 3.35917
94 2Z49 AMG 3.35917
95 6F3G CJN 3.38983
96 2B9J ADP 3.39943
97 2B9I ADP 3.39943
98 2B9F ADP 3.39943
99 2B9H ADP 3.39943
100 4OCV ANP 3.43008
101 1JPA ANP 3.52564
102 5LVP ATP 3.53698
103 4OUJ LBT 3.58306
104 5ZCT ANP 3.59477
105 5MJA 7O3 3.60656
106 2PYW ADP 3.61757
107 4HNN LYS 3.75723
108 1GSA ADP 3.79747
109 1KNM LAT 3.84615
110 5TDF ADP 3.87597
111 5YK1 ANP 3.87597
112 4E1Z 0MX 3.87597
113 5EQY 5RA 3.87597
114 5A6N U7E 3.88693
115 1TQP ATP 3.90071
116 4Y0X ADP 4
117 4DFU QUE 4.03727
118 1CM8 ANP 4.08719
119 5U6C 7YS 4.12698
120 3IGO ANP 4.13437
121 5ZTN CUR 4.13437
122 2AQX ATP 4.15225
123 2R5V HHH 4.20168
124 2GQS ADP 4.21941
125 2GQR ADP 4.21941
126 1Q8Y ADE 4.28954
127 4FE2 ADP 4.31373
128 3SRV S19 4.33213
129 4LH7 1X8 4.33437
130 2ZV2 609 4.36242
131 3WV6 GAL BGC 4.39189
132 4GYI ADP 4.39277
133 5DZT AMP