Receptor
PDB id Resolution Class Description Source Keywords
1M7H 2 Å EC: 2.7.1.25 CRYSTAL STRUCTURE OF APS KINASE FROM PENICILLIUM CHRYSOGENUM: STRUCTURE WITH APS SOAKED OUT OF ONE DIMER PENICILLIUM CHRYSOGENUM APS KINASE ADENYLYLSULFATE KINASE TRANSFERASE SULFATE METABOLISM NUCLEOTIDE 2 KINASE
Ref.: LIGAND-INDUCED STRUCTURAL CHANGES IN ADENOSINE 5'-PHOSPHOSULFATE KINASE FROM PENICILLIUM CHRYSOGENUM. BIOCHEMISTRY V. 41 13672 2002
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:1301;
B:1302;
C:1304;
D:1305;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
ADX B:1303;
D:1306;
Valid;
Valid;
none;
none;
submit data
427.284 C10 H14 N5 O10 P S c1nc(...
SO4 A:1002;
A:1005;
A:1006;
A:1009;
A:1012;
B:1003;
B:1007;
C:1001;
C:1004;
C:1008;
C:1011;
D:1010;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1M7G 1.43 Å EC: 2.7.1.25 CRYSTAL STRUCTURE OF APS KINASE FROM PENICILLIUM CHRYSOGENUM STRUCTURE WITH ADP AND APS PENICILLIUM CHRYSOGENUM APS KINASE ADENYLYLSULFATE KINASE TRANSFERASE SULFATE METNUCLEOTIDE 2 KINASE
Ref.: LIGAND-INDUCED STRUCTURAL CHANGES IN ADENOSINE 5'-PHOSPHOSULFATE KINASE FROM PENICILLIUM CHRYSOGEN BIOCHEMISTRY V. 41 13672 2002
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 1M7G - ADX C10 H14 N5 O10 P S c1nc(c2c(n....
2 1M7H - ADX C10 H14 N5 O10 P S 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 6 families.
1 1M7G - ADX C10 H14 N5 O10 P S c1nc(c2c(n....
2 1M7H - ADX C10 H14 N5 O10 P S c1nc(c2c(n....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 2PEZ - GGZ C10 H13 N5 O12 P2 S c1nc(c2c(n....
2 2PEY - DAT C10 H15 N5 O9 P2 c1nc(c2c(n....
3 5CB8 Ki = 18.2 uM ADX C10 H14 N5 O10 P S c1nc(c2c(n....
4 3UIE - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
5 2OFW Ki = 17 uM ADX C10 H14 N5 O10 P S c1nc(c2c(n....
6 2OFX - PPS C10 H15 N5 O13 P2 S c1nc(c2c(n....
7 1M7G - ADX C10 H14 N5 O10 P S c1nc(c2c(n....
8 1M7H - ADX C10 H14 N5 O10 P S 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
Ligand no: 2; Ligand: ADX; Similar ligands found: 357
No: Ligand ECFP6 Tc MDL keys Tc
1 ADX 1 1
2 A2D 0.816901 0.873418
3 BA3 0.794521 0.873418
4 AP5 0.783784 0.873418
5 B4P 0.783784 0.873418
6 ADP 0.783784 0.873418
7 50T 0.776316 0.839506
8 A 0.774648 0.848101
9 AMP 0.774648 0.848101
10 AT4 0.773333 0.8875
11 AN2 0.773333 0.8625
12 M33 0.763158 0.8625
13 CA0 0.763158 0.851852
14 ATP 0.753247 0.873418
15 ACP 0.753247 0.851852
16 HEJ 0.753247 0.873418
17 AQP 0.74359 0.873418
18 PRX 0.74359 0.807229
19 APR 0.74359 0.873418
20 AR6 0.74359 0.873418
21 5FA 0.74359 0.873418
22 ABM 0.743243 0.82716
23 AGS 0.734177 0.9
24 AD9 0.734177 0.851852
25 SAP 0.734177 0.9
26 A12 0.723684 0.841463
27 AP2 0.723684 0.841463
28 SRA 0.716216 0.875
29 ANP 0.716049 0.851852
30 ACQ 0.716049 0.851852
31 5AL 0.707317 0.839506
32 PPS 0.707317 0.974684
33 ATF 0.698795 0.841463
34 AU1 0.696203 0.851852
35 SRP 0.690476 0.819277
36 6YZ 0.690476 0.851852
37 APC 0.679012 0.841463
38 TAT 0.674699 0.8875
39 T99 0.674699 0.8875
40 A22 0.674419 0.8625
41 ADV 0.670732 0.841463
42 RBY 0.670732 0.841463
43 OOB 0.666667 0.839506
44 25A 0.666667 0.85
45 8QN 0.666667 0.839506
46 5SV 0.666667 0.770115
47 A1R 0.659091 0.821429
48 AMO 0.659091 0.841463
49 PAJ 0.659091 0.802326
50 ADQ 0.659091 0.851852
51 4AD 0.659091 0.831325
52 A3R 0.659091 0.821429
53 LMS 0.657895 0.95
54 AHX 0.651685 0.811765
55 DLL 0.651685 0.839506
56 00A 0.651685 0.8
57 ADP PO3 0.650602 0.848101
58 OAD 0.644444 0.851852
59 9X8 0.644444 0.876543
60 3UK 0.644444 0.829268
61 SON 0.641975 0.819277
62 WAQ 0.637363 0.8
63 LAD 0.637363 0.781609
64 PR8 0.637363 0.772727
65 B5V 0.637363 0.819277
66 MAP 0.636364 0.831325
67 GAP 0.635294 0.807229
68 3OD 0.630435 0.851852
69 FYA 0.630435 0.817073
70 TXA 0.630435 0.841463
71 PTJ 0.630435 0.790698
72 BIS 0.630435 0.821429
73 NB8 0.630435 0.811765
74 1ZZ 0.630435 0.764045
75 ME8 0.630435 0.784091
76 25L 0.623656 0.8625
77 ALF ADP 0.62069 0.788235
78 ADP ALF 0.62069 0.788235
79 GGZ 0.617977 0.949367
80 9SN 0.617021 0.790698
81 VO4 ADP 0.613636 0.839506
82 ADP VO4 0.613636 0.839506
83 9ZD 0.611111 0.8
84 9ZA 0.611111 0.8
85 YAP 0.610526 0.809524
86 B5Y 0.610526 0.809524
87 FA5 0.610526 0.819277
88 B5M 0.610526 0.809524
89 5AS 0.609756 0.894118
90 ADN 0.605634 0.759494
91 XYA 0.605634 0.759494
92 RAB 0.605634 0.759494
93 XAH 0.604167 0.764045
94 AOC 0.6 0.740741
95 DAL AMP 0.6 0.817073
96 4UV 0.597938 0.809524
97 GTA 0.59596 0.784091
98 G3A 0.591837 0.811765
99 5N5 0.589041 0.7375
100 4UU 0.585859 0.809524
101 G5P 0.585859 0.811765
102 AFH 0.585859 0.802326
103 GA7 0.585859 0.819277
104 A4D 0.581081 0.759494
105 5CD 0.581081 0.725
106 DQV 0.58 0.8625
107 NAI 0.578431 0.821429
108 6V0 0.578431 0.811765
109 ADP BMA 0.574468 0.829268
110 LAQ 0.574257 0.804598
111 DTA 0.571429 0.753086
112 F2R 0.570093 0.766667
113 3DH 0.56962 0.719512
114 YLP 0.568627 0.747253
115 48N 0.568627 0.811765
116 A A 0.568421 0.82716
117 G5A 0.568182 0.894118
118 YLC 0.567308 0.764045
119 AP0 0.567308 0.811765
120 MTA 0.564103 0.719512
121 2A5 0.563218 0.807229
122 DND 0.563107 0.841463
123 NXX 0.563107 0.841463
124 4UW 0.563107 0.781609
125 NAX 0.563107 0.793103
126 UP5 0.563107 0.831325
127 TXD 0.563107 0.821429
128 JB6 0.5625 0.843373
129 A3P 0.559524 0.848101
130 EP4 0.558442 0.682353
131 TXE 0.557692 0.821429
132 TYM 0.557692 0.819277
133 OMR 0.557692 0.775281
134 7D5 0.556962 0.771084
135 ATR 0.556818 0.848101
136 PAP 0.556818 0.860759
137 MYR AMP 0.556701 0.744444
138 IOT 0.556604 0.73913
139 4TC 0.552381 0.811765
140 YLB 0.552381 0.747253
141 UPA 0.552381 0.821429
142 139 0.551402 0.793103
143 T5A 0.551402 0.766667
144 M2T 0.551282 0.705882
145 A5A 0.549451 0.926829
146 TAD 0.54902 0.823529
147 TSB 0.548387 0.939024
148 7D3 0.547619 0.795181
149 A4P 0.54717 0.75
150 ATP A A A 0.545455 0.8375
151 SSA 0.543478 0.916667
152 3AM 0.54321 0.8125
153 A2P 0.541176 0.835443
154 ITT 0.54023 0.825
155 7D4 0.54023 0.795181
156 54H 0.537634 0.904762
157 52H 0.537634 0.894118
158 VMS 0.537634 0.904762
159 A2R 0.537634 0.8625
160 ADJ 0.537037 0.775281
161 YLA 0.537037 0.747253
162 ZAS 0.536585 0.694118
163 J7C 0.535714 0.678161
164 AMP DBH 0.534653 0.807229
165 TYR AMP 0.534653 0.788235
166 5X8 0.534091 0.710843
167 HFD 0.533333 0.831325
168 AYB 0.53211 0.73913
169 CNA 0.53211 0.841463
170 53H 0.531915 0.894118
171 5CA 0.531915 0.916667
172 8X1 0.531915 0.863636
173 NVA LMS 0.53125 0.863636
174 6RE 0.53012 0.670455
175 AHZ 0.528846 0.764045
176 80F 0.526786 0.786517
177 M24 0.526316 0.772727
178 ARG AMP 0.524272 0.736264
179 7MD 0.524272 0.784091
180 AR6 AR6 0.524272 0.82716
181 DSH 0.52381 0.678161
182 NAD 0.522523 0.839506
183 BTX 0.522523 0.766667
184 COD 0.522523 0.76087
185 6AD 0.521739 0.823529
186 NSS 0.520833 0.916667
187 LSS 0.520833 0.873563
188 DSZ 0.520833 0.916667
189 KAA 0.520408 0.863636
190 P5A 0.520408 0.853933
191 GSU 0.520408 0.894118
192 BT5 0.517857 0.758242
193 IMO 0.517647 0.8125
194 A3N 0.517647 0.710843
195 9K8 0.515152 0.782609
196 A3D 0.513274 0.829268
197 2AM 0.512195 0.825
198 S4M 0.511628 0.645161
199 GJV 0.511628 0.662921
200 V3L 0.51087 0.85
201 LEU LMS 0.510204 0.863636
202 LPA AMP 0.509434 0.784091
203 MAO 0.505747 0.692308
204 SAH 0.5 0.694118
205 AF3 ADP 3PG 0.5 0.761364
206 YLY 0.5 0.73913
207 SFG 0.5 0.678571
208 NAE 0.495726 0.809524
209 7MC 0.495413 0.766667
210 YSA 0.495146 0.894118
211 NA7 0.494949 0.841463
212 AVV 0.494845 0.811765
213 A7D 0.494382 0.722892
214 OVE 0.494118 0.839506
215 5AD 0.493333 0.670886
216 EAD 0.491667 0.793103
217 NAQ 0.491525 0.790698
218 DZD 0.491228 0.802326
219 AAT 0.489362 0.662921
220 A5D 0.48913 0.753086
221 SA8 0.48913 0.644444
222 PGS 0.488889 0.821429
223 71V 0.488636 0.821429
224 ZID 0.487395 0.829268
225 N0B 0.487395 0.747253
226 8PZ 0.485437 0.916667
227 ARU 0.484848 0.761364
228 AV2 0.484211 0.804878
229 SAI 0.483871 0.666667
230 DAT 0.483516 0.795181
231 NAJ PZO 0.482759 0.770115
232 4TA 0.482456 0.736264
233 DTP 0.478723 0.795181
234 3AT 0.478723 0.85
235 P1H 0.475806 0.775281
236 EEM 0.473684 0.630435
237 WSA 0.472727 0.904762
238 MHZ 0.472527 0.638298
239 7C5 0.471698 0.72093
240 D5M 0.471264 0.771084
241 DA 0.471264 0.771084
242 A3G 0.471264 0.722892
243 AMP NAD 0.469565 0.817073
244 G A A A 0.469565 0.770115
245 Y3J 0.468354 0.654321
246 6C6 0.468085 0.776471
247 7D7 0.467532 0.670732
248 NAJ PYZ 0.466667 0.736264
249 NDE 0.464 0.819277
250 S7M 0.463918 0.666667
251 SMM 0.463918 0.663043
252 SAM 0.463158 0.666667
253 6IA 0.463158 0.741573
254 4YB 0.462963 0.873563
255 SFD 0.461538 0.83871
256 NJP 0.46087 0.831325
257 EO7 0.460674 0.904762
258 U A 0.457627 0.8
259 6FA 0.457364 0.766667
260 0WD 0.456897 0.811765
261 A G 0.456897 0.77907
262 FB0 0.456693 0.71875
263 NDC 0.456693 0.790698
264 NEC 0.454545 0.674699
265 2SA 0.453608 0.819277
266 U A G G 0.452991 0.77907
267 A6D 0.45098 0.696629
268 PO4 PO4 A A A A PO4 0.45098 0.8125
269 A A A 0.45098 0.817073
270 FDA 0.449612 0.741935
271 AAM 0.449438 0.848101
272 DDS 0.447917 0.771084
273 62F 0.447761 0.784091
274 Z5A 0.447154 0.712766
275 AMZ 0.447059 0.802469
276 C2R 0.447059 0.792683
277 649 0.446429 0.853933
278 A3S 0.445652 0.731707
279 7DD 0.445652 0.860759
280 0UM 0.445545 0.637363
281 NDP 0.443478 0.811765
282 RGT 0.443396 0.841463
283 101 0.443182 0.771084
284 8Q2 0.442478 0.885057
285 62X 0.441176 0.610526
286 N6P 0.441176 0.8
287 FAD 0.439394 0.775281
288 FAS 0.439394 0.775281
289 AIR 0.439024 0.7875
290 KB1 0.438095 0.637363
291 128 0.4375 0.691489
292 K15 0.436893 0.623656
293 NIA 0.436782 0.727273
294 A3T 0.43617 0.740741
295 ODP 0.435897 0.802326
296 GEK 0.435644 0.709302
297 S8M 0.435644 0.709302
298 6K6 0.435644 0.814815
299 V1N 0.435185 0.82716
300 AS 0.433333 0.797619
301 7RA 0.433333 0.8375
302 SLU 0.433333 0.883721
303 7DT 0.431579 0.860759
304 NPW 0.431034 0.784091
305 RFL 0.430657 0.75
306 8BR 0.428571 0.797619
307 SXZ 0.428571 0.666667
308 TXP 0.42735 0.811765
309 NZQ 0.42735 0.802326
310 NVA 2AD 0.427083 0.689655
311 3AD 0.426829 0.725
312 FNK 0.426471 0.71875
313 APU 0.426087 0.788235
314 A U 0.426087 0.788235
315 TM1 0.424528 0.688172
316 FAY 0.423358 0.784091
317 VRT 0.42268 0.697674
318 SO8 0.42268 0.714286
319 7RP 0.422222 0.810127
320 26A 0.421687 0.690476
321 2VA 0.421053 0.722892
322 12D 0.419643 0.698925
323 RP1 0.41573 0.82716
324 ACK 0.41573 0.775
325 QQY 0.41573 0.780488
326 SP1 0.41573 0.82716
327 PUA 0.414634 0.781609
328 TAP 0.412698 0.843373
329 CC5 0.4125 0.734177
330 3L1 0.409639 0.698795
331 3D1 0.409639 0.698795
332 CMP 0.408602 0.810127
333 2BA 0.408602 0.822785
334 9JJ 0.408451 0.784091
335 XNP 0.408333 0.772727
336 GP3 0.408163 0.811765
337 DCA 0.406504 0.734043
338 ETB 0.406504 0.741935
339 GMV 0.405941 0.790698
340 NAP 0.404762 0.829268
341 2FA 0.404762 0.73494
342 QQX 0.404494 0.792683
343 GDP 0.40404 0.809524
344 P5F 0.402778 0.734043
345 FAI 0.402174 0.802469
346 RMB 0.402174 0.7625
347 P2P 0.402174 0.790123
348 JLN 0.402174 0.780488
349 GCP 0.401961 0.790698
350 ANZ 0.401786 0.707865
351 1DG 0.401575 0.811765
352 DG1 0.401575 0.811765
353 COA 0.4 0.752688
354 5F1 0.4 0.642857
355 0T1 0.4 0.734043
356 103 0.4 0.73494
357 GNH 0.4 0.8
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: 1
This union binding pocket(no: 1) in the query (biounit: 1m7g.bio1) has 46 residues
No: Leader PDB Ligand Sequence Similarity
1 4CVN ADP 8.75912
Pocket No.: 2; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: 1
This union binding pocket(no: 2) in the query (biounit: 1m7g.bio1) has 29 residues
No: Leader PDB Ligand Sequence Similarity
1 4PPF FLC 6.63507
Pocket No.: 3; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: 1
This union binding pocket(no: 3) in the query (biounit: 1m7g.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
1 4CVN ADP 8.75912
Pocket No.: 4; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1m7g.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 1m7g.bio5) has 32 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 1m7g.bio5) has 46 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 1m7g.bio5) has 33 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1m7g.bio5) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 1m7g.bio5) has 31 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 1m7g.bio5) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 1m7g.bio5) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 1m7g.bio5) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 13; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 13) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 14; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 14) in the query (biounit: 1m7g.bio4) has 46 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 15; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 15) in the query (biounit: 1m7g.bio4) has 33 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 16; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 16) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 17; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 17) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 18; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 18) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 19; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 19) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 20; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 20) in the query (biounit: 1m7g.bio4) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 21; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 21) in the query (biounit: 1m7g.bio2) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 22; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 22) in the query (biounit: 1m7g.bio2) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 23; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 23) in the query (biounit: 1m7g.bio2) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 24; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 24) in the query (biounit: 1m7g.bio2) has 33 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 25; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 25) in the query (biounit: 1m7g.bio3) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 26; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 26) in the query (biounit: 1m7g.bio3) has 46 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 27; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 27) in the query (biounit: 1m7g.bio3) has 33 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 28; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 28) in the query (biounit: 1m7g.bio3) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 29; Query (leader) PDB : 1M7G; Ligand: AV2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 29) in the query (biounit: 1m7g.bio3) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 30; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 30) in the query (biounit: 1m7g.bio3) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 31; Query (leader) PDB : 1M7G; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 31) in the query (biounit: 1m7g.bio3) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 32; Query (leader) PDB : 1M7G; Ligand: ADX; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 32) in the query (biounit: 1m7g.bio3) has 30 residues
No: Leader PDB Ligand Sequence Similarity
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