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Receptor
PDB id Resolution Class Description Source Keywords
4LYA 2.45 Å NON-ENZYME: OTHER ESSC (ATPASES 2 AND 3) FROM GEOBACILLUS THERMODENITRIFICANS GEOBACILLUS THERMODENITRIFICANS ESX SECRETION ESSC TYPE VII SECRETION CELL CYCLE
Ref.: SUBSTRATES CONTROL MULTIMERIZATION AND ACTIVATION O MULTI-DOMAIN ATPASE MOTOR OF TYPE VII SECRETION. CELL(CAMBRIDGE,MASS.) V. 161 501 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP A:1503;
A:1502;
Valid;
Valid;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MG A:1501;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4LYA 2.45 Å NON-ENZYME: OTHER ESSC (ATPASES 2 AND 3) FROM GEOBACILLUS THERMODENITRIFICANS GEOBACILLUS THERMODENITRIFICANS ESX SECRETION ESSC TYPE VII SECRETION CELL CYCLE
Ref.: SUBSTRATES CONTROL MULTIMERIZATION AND ACTIVATION O MULTI-DOMAIN ATPASE MOTOR OF TYPE VII SECRETION. CELL(CAMBRIDGE,MASS.) V. 161 501 2015
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 4LYA - ATP C10 H16 N5 O13 P3 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 1205 families.
1 4LYA - ATP C10 H16 N5 O13 P3 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 1039 families.
1 4LYA - ATP C10 H16 N5 O13 P3 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
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4LYA; Ligand: ATP; Similar sites found with APoc: 585
This union binding pocket(no: 1) in the query (biounit: 4lya.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
1 5TSH ADP 1.07335
2 5TSH ANP 1.07335
3 2O0J ADP 1.2987
4 2IS6 ADP 1.43113
5 3LAD FAD 1.47059
6 2QZ4 ADP 1.52672
7 1Q19 APC 1.59046
8 1G7S GDP 1.61002
9 4IOK XPO 1.61002
10 4IOK ADP 1.61002
11 1QHG ATP 1.61002
12 6C90 ADP 1.61002
13 3RC3 ANP 1.61002
14 3TBK ANP 1.62162
15 1GOJ ADP 1.69014
16 2VVG ADP 1.71429
17 4WZ6 ATP 1.72414
18 1PN4 HDC 1.78571
19 2FSH ANP 1.78891
20 4A4Z ANP 1.78891
21 1QF5 GDP 1.85615
22 1QF5 RPL 1.85615
23 3FYH ADP 1.86335
24 3CTY FAD 1.88088
25 2A2C ADP 1.88285
26 2A2C NG1 1.88285
27 5HR5 ADP 1.88324
28 2GDJ ANP 1.89394
29 2I4I AMP 1.91847
30 5BYK A3P 1.9305
31 5BYK OAQ 1.9305
32 5TIV A3P 1.97628
33 1D2E GDP 2.01511
34 1G41 ADP 2.02703
35 1CR1 TTP 2.02703
36 1YTM ATP 2.14669
37 4YS0 ADP 2.14669
38 2XAU ADP 2.14669
39 4RD0 GDP 2.16867
40 3DZD ADP 2.17391
41 5MEX SZZ 2.17391
42 5MEX PAP 2.17391
43 4KBF AMP 2.19178
44 1KK1 GNP 2.19512
45 1V8K ANP 2.19512
46 5LB3 ADP 2.24719
47 3MD0 GDP 2.25352
48 1MKY GDP 2.2779
49 3ZFD ANP 2.2792
50 5Y6N ADP 2.28311
51 5L3W GDP 2.28758
52 5AK0 8V1 2.30769
53 1IHU AF3 2.32558
54 1IHU ADP 2.32558
55 1OS1 PYR 2.32558
56 1OS1 ATP 2.32558
57 4R43 GDP 2.32558
58 5BN3 ADP 2.32558
59 2GK6 ADP 2.32558
60 4IHQ ADP 2.33918
61 1BO4 COA 2.38095
62 1G6O ADP 2.42424
63 2RGX AP5 2.42718
64 2Q2Y ADP 2.45232
65 2Q2Y MKR 2.45232
66 3VPD BUA 2.4911
67 4BFW ZVW 2.51572
68 1Z83 AP5 2.55102
69 5ZXD ATP 2.5641
70 2QEN ADP 2.57143
71 1QF9 ALF 2.57732
72 1QF9 ADP 2.57732
73 1QF9 C5P 2.57732
74 2ZR9 DTP 2.5788
75 1NY5 ADP 2.58398
76 1H65 GDP 2.59259
77 1SQ5 ADP 2.5974
78 4PTN PYR 2.62391
79 3B9Q MLI 2.64901
80 2DPY ADP 2.68336
81 1DAR GDP 2.68336
82 2FAH GDP 2.68336
83 4IDN GNP 2.68336
84 3COB ADP 2.71003
85 3TK1 GDP 2.72727
86 1NST A3P 2.76923
87 1UJ2 ADP 2.77778
88 1UJ2 C5P 2.77778
89 2OG2 MLI 2.78552
90 4TTQ ATP 2.7907
91 1SVK ALF GDP 2.83286
92 4ASE AV9 2.83286
93 1TDF FAD 2.8481
94 4LC1 GDP 2.86225
95 2CE7 ADP 2.86225
96 4GOX A3P 2.8754
97 4M0R 644 2.90237
98 2XT3 ADP 2.90698
99 6AU6 GDP 2.91777
100 4R98 GNH 2.95203
101 3BFV ADP 2.95203
102 2PL3 ADP 2.9661
103 1SKQ GDP 2.98851
104 5L3R GCP 2.99003
105 2WIC GNP 2.99625
106 1U0J ADP 2.99625
107 1Q20 A3P 3.01003
108 1Q20 PLO 3.01003
109 2WKQ GTP 3.01205
110 2Y65 ADP 3.0137
111 2GWH A3P 3.02013
112 4B47 GDP 3.0303
113 1Y3A GDP 3.03951
114 4PFO ADP 3.04114
115 2D7D ADP 3.04114
116 1F5N GNP 3.04114
117 3QVV A3P 3.05085
118 3QVV 3QV 3.05085
119 3FVQ ATP 3.06407
120 2C9O ADP 3.07018
121 5EXT ADP 3.07692
122 2OM2 GDP 3.07692
123 1TAD ALF 3.08642
124 1TAD GDP 3.08642
125 1X8J A3P 3.1339
126 4HUT ATP 3.14136
127 1BH2 GSP 3.1746
128 3WXM GTP 3.19149
129 4ZG4 VO4 ADP 3.22004
130 3EVF GTA 3.2491
131 1NN5 2DT 3.25581
132 1NN5 ANP 3.25581
133 2GZ3 NAP 3.27869
134 1P72 ADP 3.29341
135 1D8T GDP 3.30789
136 2BVN GNP 3.30789
137 2IXE ATP 3.32103
138 1E2K TMC 3.32326
139 2RCN GDP 3.35196
140 5FG3 GDP 3.37079
141 6F97 FAD 3.38983
142 4IEE AGS 3.39893
143 2GMV UN8 3.39893
144 5MZN ADP 3.39893
145 1NHX FTB 3.39893
146 2ZPA ADP 3.39893
147 2GMV PEP 3.39893
148 1NHX PEP 3.39893
149 2ZPT A3P 3.39893
150 4ZDJ UTP 3.39893
151 3W5J GDP 3.43137
152 1B0U ATP 3.43511
153 2BEK ATP 3.50195
154 4BAS GNP 3.51759
155 2QG6 NMN 3.51759
156 2ZFI ADP 3.55191
157 4AG5 ADP 3.57143
158 1U8Z GDP 3.57143
159 2C77 GNP 3.57782
160 1XKV ATP 3.57782
161 3VX3 ADP 3.62903
162 1RRC ADP 3.65448
163 3AB3 GDP 3.65854
164 1XX6 ADP 3.66492
165 2WOJ ADP ALF 3.67232
166 3DKP ADP 3.67347
167 4XTR ADP 3.68664
168 4XTR ATP 3.68664
169 4XVU ATP 3.68664
170 3B5J 12D 3.7037
171 1G7C 5GP 3.71179
172 3BFX A3P 3.71622
173 1JI0 ATP 3.75
174 2J0V GDP 3.77358
175 5KSZ GCP 3.77358
176 3G5N PB2 3.78151
177 4UXH T5A 3.80435
178 4LJ9 ACP 3.83481
179 4NON GDP 3.84615
180 1JPA ANP 3.84615
181 2ORV 4TA 3.84615
182 1JJV ATP 3.8835
183 3NHB ADP 3.92157
184 1X6V ADP 3.9356
185 3EC1 GDP 3.9356
186 1Z6T ADP 3.9356
187 5I0H ADP BEF 3.9356
188 1ZX5 LFR 3.9356
189 1OXV ANP 3.96601
190 2HF9 GSP 3.9823
191 3UIE ANP 4
192 5XKT GNP 4
193 2A5F GTP 4
194 2VB6 ADP BEF 4.02685
195 5KDO GDP 4.05405
196 2GJ8 ALF GDP 4.06977
197 3GJ0 GDP 4.0724
198 3GJ3 GDP 4.0724
199 3GJ5 GDP 4.0724
200 1GOT GDP 4.10959
201 1TQ4 GDP 4.11622
202 3REF GDP 4.12371
203 3L6C MLI 4.12979
204 4FRZ ADP 4.14508
205 3CH5 GDP 4.16667
206 3FB4 AP5 4.16667
207 3TMK T5A 4.16667
208 1IBR GNP 4.16667
209 3KO8 NAD 4.16667
210 4FCW ADP 4.18006
211 3M1I GTP 4.18848
212 1Z06 GNP 4.2328
213 2ODE ALF GDP 4.25532
214 3A1S GDP 4.26357
215 2A9K GDP 4.27807
216 2NCD ADP 4.28571
217 2YOH WMJ 4.28571
218 1O9U ADZ 4.28571
219 6CS8 F9Y 4.29043
220 5WRJ A3P 4.29338
221 5WRI A3P 4.29338
222 1MH1 GNP 4.30108
223 2W2X GSP 4.32432
224 5UPK GNP 4.32432
225 3B7G ANP 4.34783
226 3DC4 ADP 4.36047
227 4CVN ADP 4.37956
228 2JAQ DCP 4.39024
229 2IVD FAD 4.39331
230 1D2N ANP 4.41176
231 3QKT ANP 4.42478
232 3H4S ADP 4.44444
233 3FWY ADP 4.4586
234 2CDN ADP 4.47761
235 2FJU GSP 4.49438
236 1FP6 ADP 4.49827
237 4QOS ADP 4.5283
238 5ZBR ANP 4.53333
239 3QXC ATP 4.54545
240 5H4S RAM 4.57746
241 3DEF GDP 4.58015
242 4NU0 AP5 4.60829
243 1S3G AP5 4.60829
244 1F9V ADP 4.61095
245 1W5T ANP 4.61165
246 1W5T ADP 4.61165
247 1W4R TTP 4.61538
248 1W7J ADP BEF 4.63576
249 1R6B ADP 4.65116
250 3H86 AP5 4.6875
251 4WZA ACP 4.71014
252 4WZA ADP 4.71014
253 2JJK R15 4.73373
254 1FQK GDP 4.7619
255 4QRH 0O2 4.7619
256 1XMV ADP 4.77528
257 1KAO GDP 4.79042
258 2D2F ADP 4.8
259 3IUY AMP 4.82456
260 1KSH GDP 4.83871
261 4M9Q GNP 4.84582
262 2WHX ADP 4.85437
263 2J5V PCA 4.90463
264 4U00 ADP 4.91803
265 1RYH GNP 4.92611
266 2C78 GNP 4.93827
267 1MR3 G3D 4.97238
268 3IIJ ADP 5
269 1AKY AP5 5
270 4Q1A UDP 5
271 4Q1A 2XZ 5
272 4NCN GTP 5.03282
273 1AQU A3P 5.05051
274 1G3Q ADP 5.06329
275 4ITM ATP 5.07937
276 5XC5 GTP 5.11364
277 1WA5 GTP 5.11364
278 3KJI ADP 5.11811
279 2G77 GDP 5.12195
280 3PQC GDP 5.12821
281 4X8O AP5 5.14019
282 1T5C ADP 5.15759
283 4DID GDP 5.18135
284 1I4D GDP 5.20833
285 1E96 GTP 5.20833
286 1OIV GDP 5.2356
287 1OIX GDP 5.2356
288 1A4R GNH 5.2356
289 1A4R GDP 5.2356
290 4ITR GDP 5.2356
291 4QM7 GTP 5.26316
292 5KUT GDP 5.29101
293 5BQ5 ADP BEF 5.29101
294 1VG0 GDP 5.31401
295 1VG8 GNP 5.31401
296 2WJG GDP 5.31915
297 5LLB 6YZ 5.32319
298 3SBD GNP 5.34759
299 1ION ADP 5.34979
300 3A4M ADP 5.38462
301 1G3M A3P 5.44218
302 1G3M PCQ 5.44218
303 1J99 AND 5.46075
304 4RUS NAG 5.46218
305 2B8W ALF 5GP 5.4878
306 2F9L GDP 5.52764
307 4HSE ADP 5.54156
308 5ZB0 ADP 5.55556
309 5ZB0 TYD 5.55556
310 1SVM ATP 5.57029
311 3AB4 THR 5.61798
312 4KFU ACP 5.66038
313 1RJ9 GCP 5.66667
314 1HE1 GDP 5.68182
315 4H1V GNP 5.69106
316 2Z5F A3P 5.7047
317 4R2I ANP 5.71429
318 3QBT GNP 5.74713
319 5YT0 GDP 5.76923
320 4LPS GDP 5.78512
321 3BOS CDP 5.78512
322 3E70 GDP 5.79268
323 5NUL FMN 5.7971
324 5X40 ACP 5.82192
325 1W0J ADP 5.88235
326 1W0J ADP BEF 5.88235
327 1LVK MNT BEF 5.9034
328 3CX8 GSP 5.91133
329 3Q85 GNP 5.91716
330 1VKJ A3P 5.96491
331 2IYL GDP 5.98592
332 2WJH GDP 6.0241
333 2WJH FLC 6.0241
334 3BER AMP 6.0241
335 1KY3 GDP 6.04396
336 1XEX ATP 6.04396
337 3KTA AP5 6.04396
338 4PJ3 ANP 6.08229
339 4OI4 ATP 6.08696
340 6G14 G4P 6.12245
341 1SVI GDP 6.15385
342 5UIV ADP 6.1674
343 1X1R GDP 6.17978
344 1G6H ADP 6.22568
345 4GLL NAD 6.23145
346 2CJW GDP 6.25
347 2V2V V12 6.27306
348 2BCG GDP 6.31068
349 1YQT ADP 6.3197
350 5CK5 GDP 6.32911
351 1IWE IMP 6.34573
352 5U32 GDP 6.35593
353 2HV8 GTP 6.39535
354 2W58 ADP 6.43564
355 5Z69 AGS 6.44007
356 1BG2 ADP 6.46154
357 1M5B BN1 6.46388
358 1YVD GNP 6.50888
359 5HCN GCP 6.51341
360 4HDO GNP 6.52174
361 1M7B GTP 6.52174
362 5YV5 ADP 6.52985
363 1XP8 AGS 6.55738
364 3T1O GDP 6.56566
365 2D7C GTP 6.58683
366 2GKS ADP 6.59341
367 1T8U A3P 6.61765
368 1T8U UAP SGN IDS SGN 6.61765
369 5N69 ADP 6.61896
370 1K6M AGS 6.61896
371 1M7G AV2 6.63507
372 1M7G ADX 6.63507
373 1M7G ADP 6.63507
374 2JLR ANP 6.65188
375 2PEZ DAT 6.70391
376 2PEZ GGZ 6.70391
377 2A5J GDP 6.80628
378 4GBM A3P 6.81115
379 2BIF SIN 6.82303
380 2BIF ANP 6.82303
381 4GLW NMN 6.88525
382 1ZJ6 G3D 6.95187
383 1OE0 TTP 6.95652
384 6CIT GNP 6.99301
385 5UWI GNP 6.99301
386 5UWS GNP 6.99301
387 5UWO GNP 6.99301
388 5UWT GNP 6.99301
389 5UWQ GNP 6.99301
390 5UWU GNP 6.99301
391 5UWP GNP 6.99301
392 5DIF GNP 6.99301
393 5UWW GNP 6.99301
394 5UWJ GNP 6.99301
395 5DHF GNP 6.99301
396 5OJ7 AR6 6.99301
397 1YZN GNP 7.02703
398 1YZQ GNP 7.05882
399 2ZEJ GDP 7.06522
400 2CHG ANP 7.07965
401 3ZQ6 ADP ALF 7.09877
402 5NM7 GLY 7.14286
403 4NE2 SH2 7.15563
404 4NE2 ADP 7.15563
405 3HU3 AGS 7.15746
406 1NJF AGS 7.2
407 1NJF ADP 7.2
408 1L2T ATP 7.23404
409 1Z0F GDP 7.26257
410 1KO8 6PG 7.42857
411 1PUJ GNP 7.44681
412 1FNN ADP 7.45501
413 1OYY AGS 7.45698
414 2HT6 GDP 7.47126
415 1Z0A GDP 7.47126
416 6AIC AMP 7.47664
417 4P4T GDP 7.5
418 5IRC GDP 7.52688
419 4PX9 ADP 7.53425
420 2FFQ GSP 7.60234
421 2AWN ADP 7.61155
422 3RLF ANP 7.61155
423 1Z08 GNP 7.64706
424 6B4K ANP 7.67442
425 5L3V GDP 7.69231
426 5L3S GNP 7.71812
427 5M04 GDP 7.77778
428 3Q72 GNP 7.83133
429 4HAT GNP 7.85714
430 2XTZ GSP 7.9096
431 5OCG GNP 7.93651
432 1ZC3 GNP 7.9646
433 1DAK ADP 8.03571
434 1DAK DPU 8.03571
435 2BME GNP 8.06452
436 1LVG ADP 8.08081
437 4D0N GDP 8.10811
438 5TAR GDP 8.10811
439 5HPY GDP 8.10811
440 5TB5 GDP 8.10811
441 1KMQ GNP 8.15217
442 1CXZ GSP 8.24176
443 5KSP GDP 8.42105
444 3RAB GNP 8.87574
445 1YZG GDP 8.93855
446 5GVR LMR 8.97436
447 6D5V GNP 8.98204
448 6D5J GNP 8.98204
449 6D55 GNP 8.98204
450 6D5G GNP 8.98204
451 6D5H GNP 8.98204
452 6D5L GNP 8.98204
453 1GUA GNP 8.98204
454 6D56 GNP 8.98204
455 6D59 GNP 8.98204
456 6BVL GNP 8.98204
457 6D5E GNP 8.98204
458 6BVJ GNP 8.98204
459 6BVK GNP 8.98204
460 6BVI GNP 8.98204
461 6D5M GNP 8.98204
462 6BVM GNP 8.98204
463 1WQ1 GDP 9.03614
464 3KUD GDP 9.03614
465 1CLU DBG 9.03614
466 5WLB GNP 9.03614
467 1O3Y GTP 9.03614
468 1NVV GNP 9.03614
469 3DDC GNP 9.03614
470 2UZI GTP 9.03614
471 1S9D GDP 9.14634
472 1RE0 GDP 9.14634
473 4YMU ATP 9.16667
474 4C4P GNP 9.34579
475 1G16 GDP 9.41177
476 3P4X ADP 9.4431
477 5O2T GSP 9.46746
478 1QHH ATP 9.56522
479 1IN4 ADP 9.58084
480 6FA4 GNP 9.82659
481 1UKZ ADP 9.85222
482 1FZQ GDP 9.94475
483 1F2U ATP 10.0671
484 1F6B GDP 10.101
485 5O74 GDP 10.1523
486 3BC1 GNP 10.1695
487 1S8F GDP 10.1695
488 3GJ7 GDP 10.2041
489 5I34 GDP 10.2041
490 6DEF GCP 10.2302
491 6B8B ADP 10.4418
492 3T5G GDP 10.4972
493 5X80 SAL 10.625
494 1GWN GTP 10.7317
495 1OW3 GDP 10.7438
496 4BQS ADP 10.7955
497 4BQS K2Q 10.7955
498 2KIN ADP 10.9244
499 2GCN GDP 10.9453
500 2GCO GNP 10.9453
501 4TL6 ANP 11.0672
502 1YRB GDP 11.0687
503 2NGR GDP 11.1111
504 1ZD9 GDP 11.1702
505 4K81 GTP 11.2403
506 3BD9 A3P 11.4286
507 1VHT BA3 11.4679
508 1OFH ADP 11.4943
509 5F90 GLA GAL 11.5385
510 5F90 GLA GAL BGC 5VQ 11.5385
511 5F90 LMR 11.5385
512 1EK0 GNP 11.7647
513 4U5X GNP 11.7978
514 4DCT GDP 11.8421
515 1Z2A GDP 11.9048
516 1ZUI SKM 11.9048
517 1WF3 GNP 11.9857
518 4D81 ADP 12.0141
519 1JJ7 ADP 12.3077
520 6BSX E7S 12.3596
521 6BSX GDP 12.3596
522 1VG1 GDP 12.4324
523 1VG9 GDP 12.4324
524 2QQ0 THM 12.5
525 2QQ0 ANP 12.5
526 2QQ0 TMP 12.5
527 2QQ0 ADP 12.5
528 5BXQ GDP 12.5984
529 1GRN GDP 12.8079
530 1D5C GDP 12.963
531 5Z2M GTP 13.0682
532 1TX4 ALF GDP 13.1313
533 4TMK T5A 13.1455
534 1CS4 GSP 13.2075
535 1UPT GTP 13.3333
536 2OFW ADX 13.4615
537 2FH5 GTP 13.5135
538 4HI0 GDP 13.5678
539 1NF3 GNP 13.8462
540 2C5L GTP 13.8728
541 2CK3 ANP 14
542 2CK3 ADP 14
543 4WOP CTP 14.2222
544 4ZNL BEF ADP 14.2336
545 5UQW GDP 14.2857
546 1FQJ GDP 14.2857
547 4MKF AP5 14.7465
548 1G4U GDP 14.8479
549 2F3R G5P 14.9758
550 1R2Q GNP 15.2941
551 1B7T ADP 15.3846
552 3MJH GTP 15.4762
553 1DS6 GDP 15.5556
554 1ZIN AP5 15.6682
555 4MKG AP5 15.6682
556 1R4A GNP 15.6863
557 1M2O GNP 15.7895
558 3QF7 ANP 16
559 2XTN GTP 16.2393
560 1TU3 GNP 16.4557
561 1KK8 BEF ADP 17.2662
562 1J2J GTP 17.7778
563 3GJ4 GDP 18.1818
564 5UWH GNP 18.1818
565 2V7Q ATP 18.1818
566 2V7Q ADP 18.1818
567 1Z0J GTP 18.6441
568 1GXU 2HP 18.6813
569 1Z0K GTP 18.8406
570 3ZIA ADP 19.0476
571 3ZIA ATP 19.0476
572 3T12 GDP ALF 19.8529
573 4V0K GDP 20.1183
574 3GJ8 GDP 20.6522
575 3RWO GDP 21.0811
576 5DI9 GNP 23.8095
577 2QTV GNP 24.4898
578 1LFD GNP 27.5862
579 1NRJ GTP 30.7339
580 6CRK GDP 30.9859
581 1GP2 GDP 30.9859
582 3ZS9 ADP ALF 31.5789
583 5UWR GNP 33.3333
584 2HCJ GDP 35.1351
585 2QN6 GDP 44.4444
Pocket No.: 2; Query (leader) PDB : 4LYA; Ligand: ATP; Similar sites found with APoc: 64
This union binding pocket(no: 2) in the query (biounit: 4lya.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
1 2VBQ BSJ None
2 3EYA TDP 1.25224
3 3CV2 OXL 1.31579
4 6HOY AR6 1.3245
5 6HOY TSN 1.3245
6 3ZG6 APR 1.35135
7 1TLL FMN 1.43113
8 4AF0 IMP 1.43885
9 2VOS ADP 1.84805
10 2C6Q IMP 1.9943
11 2WPW ACO 2.0649
12 1YKF NAP 2.27273
13 4DDY DN6 2.28137
14 5EP2 AZU 2.34375
15 3MGB PAP 2.50784
16 5AYV KPL 2.589
17 3M54 SAH 2.68199
18 6FDF SAH 2.69461
19 2XZ9 PYR 2.77778
20 3ZJ0 ACO 2.86225
21 4UTG ANP 2.89017
22 1I1N SAH 3.09735
23 1EB1 ZAL PRO MMO 3.11284
24 4Z0G 5GP 3.1477
25 2ZE7 AMP 3.16206
26 2ZE7 DST 3.16206
27 3ZL8 ADP 3.20366
28 2X7I CIT 3.24675
29 2PZ8 APC 3.52113
30 1T3Q MCN 3.57782
31 4TXI FAD 3.57782
32 1U3G THF 3.7037
33 2H29 DND 3.7037
34 1CJW COT 3.75671
35 4KVX ACO 3.84615
36 1KUV CA5 3.86473
37 2B8T THM 4.03587
38 1FIQ FAD 4.10959
39 5LLT DND 4.22535
40 4YRY FAD 4.34783
41 4YRY NAD 4.34783
42 1P9B GDP 4.52489
43 1P3D ANP 4.84211
44 1GQY ACP 4.84211
45 4OR7 NAP 4.84848
46 2VWT PYR 5.24345
47 3R7F CP 5.59211
48 3ITJ CIT 5.91716
49 1ZRH A3P 6.20438
50 4CRZ ACO 6.29371
51 1YRO GDU 6.64336
52 3MB5 SAM 6.66667
53 5JCA FAD 6.69014
54 1FFU FAD 6.74847
55 1FFU CDP 6.74847
56 1N62 FAD 7.63889
57 3DAA PDD 8.66426
58 5E5U MLI 10.6061
59 2VHJ ADP 10.8761
60 3RNM FAD 13.7931
61 5LS7 ACO 17.0732
62 5XQL C2E 18.2131
63 4NSQ COA 18.4211
64 3B1J NAD 32
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