Receptor
PDB id Resolution Class Description Source Keywords
4WOE 2.3 Å EC: 2.7.3.4 THE DUPLICATED TAUROCYAMINE KINASE FROM SCHISTOSOMA MANSONI TRANSITION STATE ANALOG (TSA) COMPONENTS SCHISTOSOMA MANSONI TRANSFERASE DUPLICATED SUBSTRATE SPECIFICITY TRANSITION S
Ref.: THE SUBSTRATE-FREE AND -BOUND CRYSTAL STRUCTURES OF DUPLICATED TAUROCYAMINE KINASE FROM THE HUMAN PARAS SCHISTOSOMA MANSONI. J.BIOL.CHEM. V. 290 12951 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP B:802;
A:802;
A:801;
B:801;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Kd = 3.8 uM
427.201 C10 H15 N5 O10 P2 c1nc(...
MG A:806;
A:805;
B:805;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
NO3 A:807;
A:808;
Invalid;
Invalid;
none;
none;
submit data
62.005 N O3 [N+](...
3S5 B:804;
A:804;
B:803;
A:803;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
167.187 C3 H9 N3 O3 S [H]/N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4WOE 2.3 Å EC: 2.7.3.4 THE DUPLICATED TAUROCYAMINE KINASE FROM SCHISTOSOMA MANSONI TRANSITION STATE ANALOG (TSA) COMPONENTS SCHISTOSOMA MANSONI TRANSFERASE DUPLICATED SUBSTRATE SPECIFICITY TRANSITION S
Ref.: THE SUBSTRATE-FREE AND -BOUND CRYSTAL STRUCTURES OF DUPLICATED TAUROCYAMINE KINASE FROM THE HUMAN PARAS SCHISTOSOMA MANSONI. J.BIOL.CHEM. V. 290 12951 2015
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4WOD - ARG C6 H15 N4 O2 C(C[C@@H](....
2 4WOE Kd = 3.8 uM 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 1 families.
1 4WOD - ARG C6 H15 N4 O2 C(C[C@@H](....
2 4WOE Kd = 3.8 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4RF8 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
2 4RF7 - ARG C6 H15 N4 O2 C(C[C@@H](....
3 4RF9 - ARG C6 H15 N4 O2 C(C[C@@H](....
4 4WOD - ARG C6 H15 N4 O2 C(C[C@@H](....
5 4WOE Kd = 3.8 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP; Similar ligands found: 435
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 ATP 0.9 1
3 A2D 0.895522 0.971831
4 AQP 0.887324 1
5 5FA 0.887324 1
6 AP5 0.884058 0.971831
7 B4P 0.884058 0.971831
8 BA3 0.869565 0.971831
9 AN2 0.84507 0.985915
10 M33 0.833333 0.958333
11 ACQ 0.826667 0.972222
12 A 0.823529 0.971429
13 AMP 0.823529 0.971429
14 ACP 0.821918 0.972222
15 AR6 0.810811 0.971831
16 APR 0.810811 0.971831
17 ANP 0.802632 0.972222
18 AD9 0.8 0.972222
19 AGS 0.8 0.945946
20 SAP 0.8 0.945946
21 ADX 0.783784 0.873418
22 CA0 0.783784 0.945205
23 TAT 0.779221 0.958904
24 AMP MG 0.774648 0.891892
25 50T 0.773333 0.958333
26 ABM 0.763889 0.917808
27 APC 0.763158 0.958904
28 PRX 0.763158 0.893333
29 ATF 0.759494 0.958904
30 A22 0.753086 0.985915
31 A12 0.743243 0.958904
32 AP2 0.743243 0.958904
33 ADP MG 0.736842 0.905405
34 SRA 0.736111 0.918919
35 ADQ 0.73494 0.945205
36 25L 0.732558 0.985915
37 ADP BEF 0.727273 0.881579
38 BEF ADP 0.727273 0.881579
39 5AL 0.725 0.931507
40 2A5 0.717949 0.918919
41 A1R 0.714286 0.907895
42 AU1 0.714286 0.972222
43 ADP PO3 0.708861 0.943662
44 PAP 0.708861 0.985714
45 ATR 0.708861 0.971429
46 SRP 0.707317 0.906667
47 7D3 0.706667 0.905405
48 25A 0.702381 0.971831
49 ATP MG 0.7 0.905405
50 OAD 0.697674 0.945205
51 RBY 0.6875 0.932432
52 ADV 0.6875 0.932432
53 00A 0.686047 0.883117
54 5SV 0.682353 0.848101
55 8QN 0.682353 0.931507
56 OOB 0.682353 0.931507
57 3OD 0.681818 0.945205
58 BIS 0.681818 0.933333
59 ADP ALF 0.674699 0.87013
60 ALF ADP 0.674699 0.87013
61 AMO 0.674419 0.932432
62 4AD 0.674419 0.92
63 PAJ 0.674419 0.884615
64 GAP 0.670732 0.893333
65 MAP 0.670588 0.945946
66 DLL 0.666667 0.931507
67 ANP MG 0.666667 0.894737
68 VO4 ADP 0.666667 0.931507
69 AHX 0.666667 0.896104
70 ADP VO4 0.666667 0.931507
71 PTJ 0.662921 0.896104
72 3UK 0.659091 0.918919
73 SON 0.658228 0.932432
74 LAD 0.651685 0.860759
75 WAQ 0.651685 0.883117
76 PR8 0.651685 0.85
77 ITT 0.65 0.943662
78 7D4 0.65 0.905405
79 G5P 0.648936 0.921053
80 RAB 0.647059 0.84507
81 ADN 0.647059 0.84507
82 XYA 0.647059 0.84507
83 TXA 0.644444 0.932432
84 1ZZ 0.644444 0.839506
85 ME8 0.644444 0.839506
86 NB8 0.644444 0.896104
87 FYA 0.644444 0.905405
88 6AD 0.642857 0.909091
89 ADP BMA 0.640449 0.918919
90 G3A 0.638298 0.921053
91 DAL AMP 0.632184 0.905405
92 AFH 0.631579 0.884615
93 9SN 0.630435 0.871795
94 GTA 0.625 0.886076
95 YAP 0.623656 0.894737
96 FA5 0.623656 0.906667
97 UP5 0.622449 0.92
98 XAH 0.617021 0.839506
99 AV2 0.616279 0.917808
100 AOC 0.615385 0.821918
101 48N 0.612245 0.896104
102 4UV 0.610526 0.894737
103 TXD 0.606061 0.907895
104 DND 0.606061 0.932432
105 NAX 0.606061 0.873418
106 NXX 0.606061 0.932432
107 NAI 0.606061 0.907895
108 6V0 0.606061 0.896104
109 5N5 0.605634 0.819444
110 5AS 0.604938 0.77907
111 A4P 0.60396 0.843373
112 DAT 0.60241 0.905405
113 A2R 0.602273 0.985915
114 TXE 0.6 0.907895
115 OMR 0.6 0.851852
116 4UU 0.597938 0.894737
117 A A 0.597826 0.944444
118 A4D 0.597222 0.819444
119 5CD 0.597222 0.805556
120 AP0 0.594059 0.896104
121 4TC 0.594059 0.896104
122 A3P 0.592593 0.971429
123 139 0.592233 0.873418
124 T5A 0.592233 0.841463
125 7D5 0.592105 0.878378
126 ATP A A A 0.589474 0.930556
127 LAQ 0.585859 0.839506
128 MYR AMP 0.585106 0.817073
129 YLP 0.58 0.819277
130 UPA 0.578431 0.907895
131 7DD 0.578313 0.985714
132 ADJ 0.576923 0.851852
133 3AM 0.576923 0.929577
134 COD 0.575472 0.811765
135 NAD 0.575472 0.931507
136 3AT 0.574713 0.971831
137 JB6 0.574468 0.883117
138 4UW 0.574257 0.860759
139 EP4 0.573333 0.753247
140 A2P 0.573171 0.957143
141 CNA 0.571429 0.932432
142 TYM 0.568627 0.906667
143 PPS 0.568182 0.873418
144 TYR AMP 0.56701 0.881579
145 DTA 0.565789 0.786667
146 M2T 0.565789 0.734177
147 AR6 AR6 0.565657 0.917808
148 A3D 0.564815 0.918919
149 3DH 0.564103 0.773333
150 G5A 0.563218 0.77907
151 YLB 0.563107 0.819277
152 YLC 0.563107 0.839506
153 AMP DBH 0.561224 0.893333
154 MTA 0.558442 0.773333
155 DTP 0.556818 0.905405
156 AHZ 0.554455 0.817073
157 NA7 0.553191 0.958904
158 IOT 0.552381 0.831325
159 7MD 0.55 0.8625
160 ZAS 0.55 0.766234
161 IMO 0.548781 0.929577
162 YLA 0.54717 0.819277
163 NAE 0.544643 0.894737
164 TAD 0.544554 0.884615
165 A5A 0.544444 0.807229
166 2AM 0.544304 0.943662
167 TSB 0.543478 0.819277
168 6RE 0.54321 0.759494
169 AYB 0.542056 0.809524
170 NAQ 0.539823 0.871795
171 V3L 0.539326 0.971831
172 ARG AMP 0.539216 0.829268
173 AF3 ADP 3PG 0.538462 0.8375
174 SSA 0.538462 0.8
175 LA8 ALF 3PG 0.538462 0.8375
176 ALF ADP 3PG 0.538462 0.8375
177 ZID 0.535088 0.918919
178 LPA AMP 0.533981 0.817073
179 54H 0.532609 0.788235
180 52H 0.532609 0.77907
181 VMS 0.532609 0.788235
182 BTX 0.53211 0.841463
183 J7C 0.53012 0.769231
184 A3N 0.53012 0.786667
185 5X8 0.528736 0.763158
186 BT5 0.527273 0.831325
187 5CA 0.526882 0.8
188 53H 0.526882 0.77907
189 ARU 0.526316 0.860759
190 EAD 0.525862 0.873418
191 RGT 0.525253 0.958904
192 OVE 0.52439 0.905405
193 S4M 0.52381 0.666667
194 7DT 0.522727 0.985714
195 GDP 0.522222 0.92
196 DDS 0.522222 0.878378
197 AVV 0.521277 0.896104
198 NDE 0.521008 0.932432
199 7MC 0.518868 0.841463
200 DSH 0.518072 0.725
201 MAO 0.517647 0.759036
202 LSS 0.515789 0.761364
203 DSZ 0.515789 0.8
204 NSS 0.515789 0.8
205 P5A 0.515464 0.744444
206 DZD 0.513514 0.884615
207 NVA LMS 0.510417 0.761364
208 12D 0.509615 0.785714
209 NAD IBO 0.509091 0.87013
210 M24 0.508772 0.85
211 YLY 0.508772 0.809524
212 P1H 0.508333 0.851852
213 5AD 0.506849 0.746479
214 GJV 0.505882 0.75
215 LEU LMS 0.505155 0.761364
216 G A A A 0.504505 0.871795
217 4TA 0.504505 0.807229
218 NAJ PZO 0.504425 0.848101
219 KAA 0.5 0.752809
220 NDC 0.5 0.871795
221 7D7 0.5 0.743243
222 71V 0.5 0.907895
223 A3G 0.5 0.8
224 128 0.5 0.776471
225 GSU 0.5 0.77907
226 N0B 0.495726 0.819277
227 NJP 0.495495 0.945946
228 ODP 0.495495 0.909091
229 2SA 0.494624 0.932432
230 6C6 0.494505 0.881579
231 SFG 0.494382 0.75
232 0WD 0.491071 0.921053
233 YSA 0.490196 0.77907
234 PO4 PO4 A A A A PO4 0.489796 0.902778
235 6IA 0.48913 0.8375
236 SAM 0.48913 0.690476
237 A7D 0.488636 0.776316
238 6FA 0.488 0.841463
239 FB0 0.487805 0.804598
240 NAJ PYZ 0.487179 0.85
241 IDP 0.483516 0.918919
242 A5D 0.483516 0.786667
243 SA8 0.483516 0.707317
244 MHZ 0.483146 0.697674
245 PGS 0.483146 0.883117
246 D5M 0.482353 0.878378
247 DA 0.482353 0.878378
248 NEC 0.482353 0.746667
249 NIA 0.481928 0.822785
250 Y3J 0.480519 0.726027
251 FAD 0.480315 0.851852
252 FAS 0.480315 0.851852
253 FDA 0.48 0.833333
254 N6P 0.479592 0.915493
255 GGZ 0.479167 0.825
256 SAH 0.478261 0.74359
257 SAI 0.478261 0.734177
258 NPW 0.477477 0.886076
259 NDP 0.477477 0.921053
260 AAM 0.476744 0.971429
261 AMZ 0.47561 0.916667
262 C2R 0.47561 0.90411
263 A A A 0.474747 0.905405
264 GTP 0.473684 0.92
265 U A G G 0.473684 0.883117
266 SMM 0.473684 0.686047
267 TXP 0.473214 0.921053
268 NZQ 0.473214 0.909091
269 A3S 0.47191 0.810811
270 AMP NAD 0.470588 0.881579
271 SFD 0.46875 0.734043
272 AIR 0.468354 0.901408
273 AAT 0.468085 0.707317
274 EEM 0.468085 0.690476
275 Z5A 0.466667 0.77907
276 7C5 0.466667 0.818182
277 J7V 0.466667 0.833333
278 62F 0.465649 0.8625
279 FAY 0.462121 0.8625
280 ETB 0.461538 0.833333
281 DCA 0.461538 0.823529
282 A3T 0.461538 0.821918
283 A6D 0.46 0.722892
284 A U 0.459459 0.87013
285 6K6 0.459184 0.930556
286 GEK 0.459184 0.7375
287 RFL 0.458647 0.821429
288 S7M 0.458333 0.690476
289 NAP 0.458333 0.945205
290 4YB 0.457944 0.761364
291 WSA 0.454545 0.788235
292 TAP 0.454545 0.907895
293 FNK 0.454545 0.804598
294 COA 0.453782 0.823529
295 0T1 0.453782 0.823529
296 101 0.453488 0.878378
297 XNP 0.452174 0.873418
298 NA0 0.45082 0.932432
299 7RP 0.448276 0.928571
300 GP3 0.446809 0.921053
301 TM1 0.446602 0.77381
302 APU 0.446429 0.894737
303 PUA 0.445378 0.884615
304 V1N 0.443396 0.917808
305 7RA 0.443182 0.957747
306 30N 0.442623 0.752688
307 CAO 0.442623 0.795455
308 AMX 0.442623 0.833333
309 COS 0.442623 0.804598
310 ACK 0.44186 0.861111
311 QQY 0.44186 0.815789
312 649 0.441441 0.744444
313 0UM 0.44 0.698795
314 NHD 0.439655 0.905405
315 CMX 0.439024 0.823529
316 SCO 0.439024 0.823529
317 GCP 0.438776 0.896104
318 8BR 0.438202 0.906667
319 GNH 0.4375 0.907895
320 3AD 0.4375 0.805556
321 62X 0.435644 0.666667
322 ACO 0.435484 0.795455
323 FCX 0.435484 0.795455
324 FAM 0.435484 0.804598
325 GNP 0.434343 0.896104
326 NMX 0.433071 0.76087
327 MGP 0.43299 0.884615
328 PLP AAD 0.432203 0.741573
329 26A 0.432099 0.763158
330 HAX 0.432 0.804598
331 K15 0.431373 0.682353
332 DG1 0.430894 0.921053
333 1DG 0.430894 0.921053
334 QQX 0.430233 0.805195
335 2VA 0.430108 0.8
336 S8M 0.43 0.759494
337 2MC 0.429688 0.769231
338 3KK 0.428571 0.804598
339 6G0 0.428571 0.884615
340 FYN 0.428571 0.823529
341 P5F 0.428571 0.823529
342 NAD BBN 0.428571 0.841463
343 U G A 0.427481 0.839506
344 AS 0.426966 0.833333
345 FAI 0.426966 0.916667
346 RMB 0.426966 0.873239
347 1RB 0.425287 0.885714
348 MCD 0.425197 0.804598
349 OXK 0.425197 0.804598
350 COK 0.425197 0.804598
351 CA6 0.425197 0.729167
352 SOP 0.425197 0.804598
353 G1R 0.424242 0.907895
354 CC5 0.423077 0.816901
355 SXZ 0.423077 0.710843
356 F2N 0.422535 0.813953
357 NAD CJ3 0.422222 0.811765
358 ANZ 0.422018 0.8
359 CMC 0.421875 0.804598
360 CO6 0.421875 0.804598
361 1VU 0.421875 0.795455
362 ZDA 0.421053 0.864865
363 GDD 0.420561 0.884615
364 GKE 0.420561 0.884615
365 GDC 0.420561 0.884615
366 NFD 0.420168 0.883117
367 GSP 0.42 0.873418
368 D3Y 0.42 0.789474
369 MC4 0.419847 0.76087
370 3L1 0.419753 0.773333
371 3D1 0.419753 0.773333
372 FA9 0.41958 0.864198
373 5GP 0.419355 0.906667
374 G 0.419355 0.906667
375 KB1 0.419048 0.698795
376 SCD 0.418605 0.823529
377 CAJ 0.418605 0.804598
378 2BA 0.417582 0.915493
379 CMP 0.417582 0.901408
380 SO8 0.416667 0.789474
381 N01 0.416667 0.905405
382 VRT 0.416667 0.769231
383 3HC 0.415385 0.813953
384 A1S 0.415385 0.804598
385 BCO 0.415385 0.804598
386 IVC 0.415385 0.813953
387 MLC 0.415385 0.804598
388 1HE 0.415385 0.786517
389 NMN AMP PO4 0.415254 0.87013
390 2FA 0.414634 0.813333
391 MGO 0.414141 0.860759
392 3NZ 0.413462 0.782051
393 MCA 0.412214 0.795455
394 CAA 0.412214 0.813953
395 YE1 0.412214 0.813953
396 COO 0.412214 0.804598
397 GAV 0.411765 0.884615
398 P2P 0.411111 0.902778
399 JLN 0.411111 0.890411
400 ZZB 0.410256 0.77381
401 CNV FAD 0.410072 0.793103
402 SCA 0.409091 0.804598
403 RP1 0.409091 0.842105
404 103 0.409091 0.837838
405 2CP 0.409091 0.795455
406 SP1 0.409091 0.842105
407 PAX 0.408 0.829268
408 FAD NBT 0.407143 0.75
409 NVA 2AD 0.40625 0.74359
410 COW 0.406015 0.795455
411 BYC 0.406015 0.804598
412 2KQ 0.406015 0.786517
413 COF 0.406015 0.786517
414 3CP 0.406015 0.804598
415 IRC 0.406015 0.813953
416 1GZ 0.406015 0.795455
417 HGG 0.406015 0.804598
418 CA8 0.406015 0.729167
419 G2P 0.405941 0.884615
420 SLU 0.404959 0.770115
421 U A C C 0.404959 0.858974
422 RBZ 0.404494 0.849315
423 1CZ 0.404412 0.795455
424 BCA 0.402985 0.795455
425 FAQ 0.402985 0.804598
426 4CA 0.402985 0.795455
427 MTP 0.402439 0.730769
428 8OD 0.402062 0.945205
429 CO7 0.401515 0.804598
430 DAL FAD PER 0.401408 0.809524
431 G2R 0.4 0.884615
432 HXC 0.4 0.786517
433 ENQ 0.4 0.916667
434 GMV 0.4 0.896104
435 GRA 0.4 0.804598
Ligand no: 2; Ligand: 3S5; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 3S5 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4WOE; Ligand: ADP; Similar sites found: 45
This union binding pocket(no: 1) in the query (biounit: 4woe.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4CQK PIO 0.03017 0.40616 None
2 1F52 ADP 0.009564 0.41708 1.06838
3 2PNC CLU 0.004593 0.45133 1.39665
4 5MRH Q9Z 0.009587 0.42554 1.43678
5 1I1E DM2 0.01041 0.42837 2.09497
6 2VFT SOR 0.01124 0.41773 2.36967
7 4BQY FNT 0.004339 0.41444 2.38095
8 2GC0 PAN 0.01202 0.40152 2.65957
9 1GPM AMP 0.03076 0.40717 2.66667
10 2GQS C2R 0.01502 0.4039 3.37553
11 5DG2 GAL GLC 0.00657 0.40329 3.7037
12 1QKQ MAN 0.0001088 0.49724 4.22535
13 1QGQ UDP 0.01994 0.40932 4.31373
14 5D9G GLU ASN LEU TYR PHE GLN 0.003899 0.4454 4.47154
15 2V0U FMN 0.01096 0.40009 4.79452
16 5DKK FMN 0.00924 0.40337 4.82759
17 5KR7 6X9 0.01385 0.40928 4.90463
18 1Y7P RIP 0.005465 0.40882 4.93274
19 2G30 ALA ALA PHE 0.0000058 0.59568 5.03876
20 4KBA 1QM 0.002896 0.45195 5.13595
21 5W4W 9WG 0.003498 0.41307 5.13595
22 2FKA BEF 0.01129 0.42898 5.42636
23 2AG4 OLA 0.001033 0.45974 5.4878
24 2AG4 LP3 0.001171 0.45974 5.4878
25 5H2U 1N1 0.01148 0.40244 5.61798
26 1DZK PRZ 0.007095 0.41551 5.73248
27 5TVF CGQ 0.02686 0.40269 5.88235
28 2XXP DSL 0.02776 0.40306 6.03015
29 2VDF OCT 0.0003971 0.48347 6.32411
30 3OYW TDG 0.02614 0.4074 6.71642
31 2YMZ LAT 0.004862 0.42124 6.92308
32 4K55 H6P 0.000009301 0.61307 7.25806
33 2XG5 EC2 0.01387 0.41053 7.51445
34 2XG5 EC5 0.01387 0.41053 7.51445
35 2D6M LBT 0.00417 0.44141 7.54717
36 5T7I LAT NAG GAL 0.01316 0.42448 7.74194
37 3ZJX BOG 0.006068 0.44348 7.95848
38 5KEW 6SB 0.02861 0.40615 9.02778
39 4DSU BZI 0.001105 0.48701 9.52381
40 4XMF HSM 0.01122 0.42271 9.78261
41 1A78 TDG 0.009531 0.4295 10.4478
42 4IAW LIZ 0.009887 0.42049 11.1702
43 1GT4 UNA 0.0007708 0.46 13.2075
44 1I7M CG 0.02417 0.40504 14.9254
45 3G08 FEE 0.01097 0.41279 16.1616
Pocket No.: 2; Query (leader) PDB : 4WOE; Ligand: 3S5; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 4woe.bio1) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 4WOE; Ligand: 3S5; Similar sites found: 21
This union binding pocket(no: 3) in the query (biounit: 4woe.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3ICS COA 0.01439 0.42882 1.02041
2 2B9W FAD 0.01123 0.45203 1.65094
3 2V58 LZJ 0.0474 0.41644 2.00445
4 1J09 GLU 0.02651 0.40615 2.99145
5 1J09 ATP 0.03022 0.40339 2.99145
6 4NJS G08 0.02065 0.42553 4.0404
7 2ZE7 AMP 0.04281 0.4009 5.92885
8 4MV1 ADP 0.03166 0.41635 5.98291
9 3BMQ NAP 0.04094 0.40259 6.25
10 5JDI NAP 0.04095 0.4017 6.25
11 3JQF NAP 0.04382 0.40067 6.25
12 5THQ NDP 0.0246 0.41806 7.35294
13 3W2E NAD 0.03451 0.41501 7.38007
14 3W2E FAD 0.03451 0.41501 7.38007
15 5FJN BE2 0.0491 0.41472 7.45614
16 5FJN FAD 0.04477 0.41472 7.45614
17 3ZS9 ADP ALF 0.03604 0.40267 7.89474
18 3SM2 478 0.01528 0.44005 8.33333
19 3T3C 017 0.01926 0.42358 9.09091
20 2AMT GPP 0.01561 0.42328 11.9497
21 3UTU 1TS 0.02633 0.41769 16.6667
Pocket No.: 4; Query (leader) PDB : 4WOE; Ligand: ADP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 4woe.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 4WOE; Ligand: ADP; Similar sites found: 308
This union binding pocket(no: 5) in the query (biounit: 4woe.bio2) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5MW8 ATP 0.02783 0.40564 1.06157
2 4AZW ATP 0.02484 0.40424 1.06157
3 1W96 S1A 0.009783 0.42376 1.44404
4 2C78 PUL 0.01022 0.46006 1.48148
5 2WKQ FMN 0.001184 0.47086 1.50602
6 1P7T ACO 0.01335 0.42409 1.53631
7 2ZQ0 ACR 0.01942 0.41 1.53631
8 4OPC PGT 0.01841 0.46417 1.54525
9 4OPC FDA 0.01654 0.46417 1.54525
10 3IWJ NAD 0.01215 0.4159 1.59046
11 4TSZ ACE GLN ALC ASP LEU ZCL 0.01965 0.40497 1.63043
12 3QSB 743 0.0008071 0.46858 1.63934
13 1X7D ORN 0.01215 0.44346 1.71429
14 3OV6 MK0 0.00745 0.44519 1.76322
15 4ZLU 4PW 0.02659 0.41978 1.78971
16 4ZLU ADP 0.02659 0.41978 1.78971
17 5H9Y BGC BGC BGC BGC 0.0004804 0.48393 1.8018
18 5HCY 60D 0.0003205 0.53282 1.81269
19 1QD1 FON 0.00584 0.44335 1.84615
20 1W8S FBP 0.006021 0.42774 1.90114
21 3KJD 78P 0.02253 0.40967 1.90217
22 4BKJ STI 0.0144 0.4236 1.90476
23 2X2M X2M 0.004525 0.44578 1.91083
24 3IAL PR8 0.02383 0.40883 1.9305
25 4HWT 1B2 0.02258 0.40305 1.93705
26 5XDT ZI7 0.001048 0.48671 1.94805
27 5XDT MB3 0.01241 0.43478 1.94805
28 5XDT GDP 0.02959 0.40734 1.94805
29 2FY3 CHT 0.04116 0.40703 1.96078
30 2FXD DR7 0.0412 0.4037 2.0202
31 3E9I XAH 0.02518 0.41548 2.0284
32 5IVE 6E8 0.02068 0.42089 2.12121
33 4NS3 NAD 0.007545 0.4287 2.13144
34 2HJR APR 0.01757 0.41521 2.13415
35 2I7N ACO 0.01384 0.41856 2.22222
36 3SXS PP2 0.002451 0.45783 2.23881
37 1OJK GLC BGC 0.01327 0.4038 2.23881
38 1KOR ANP 0.02059 0.45704 2.25
39 1KOR SIN 0.02023 0.45704 2.25
40 1KOR ARG 0.02023 0.45704 2.25
41 2Y6Q I7T 0.003915 0.47818 2.26131
42 2RCU BUJ 0.02705 0.43409 2.29709
43 2WT2 GAL NAG GAL NAG GAL NAG 0.03437 0.40156 2.33236
44 4OYA 1VE 0.002958 0.49462 2.34043
45 4WNK 453 0.03031 0.41143 2.34114
46 2ABS ACP 0.01185 0.44365 2.34987
47 3IES M24 0.02269 0.42212 2.35935
48 3AVS OGA 0.01329 0.40535 2.44821
49 1JIF CU BLM 0.001586 0.4758 2.45902
50 1OFL NGK GCD 0.003026 0.40699 2.4948
51 5E9X 5LA 0.0173 0.42947 2.51397
52 5N87 N66 0.01449 0.43487 2.55591
53 1GQG DCD 0.01104 0.42728 2.57143
54 4P25 FUC GAL NAG FUC 0.005921 0.42201 2.64901
55 4PAB THG 0.02046 0.40467 2.65363
56 1ICP FMN 0.04552 0.40142 2.65957
57 2JIG PD2 0.0143 0.40249 2.67857
58 2E0N SAH 0.02149 0.40531 2.7027
59 5KJW 53C 0.00006483 0.49538 2.8103
60 2WME NAP 0.02417 0.40263 2.85714
61 2WOX NDP 0.04215 0.40765 2.86299
62 5C5H 4YB 0.03139 0.40599 2.86976
63 4CQE CQE 0.001463 0.47173 2.8777
64 4USF 6UI 0.0002343 0.4993 2.96053
65 3GD9 GLC BGC BGC BGC 0.0009762 0.4662 2.99728
66 4QJP V1F 0.0322 0.40364 3.04183
67 1NYW DAU 0.005746 0.43668 3.04569
68 4XV1 904 0.002158 0.47739 3.08219
69 2Y6O 1N1 0.001959 0.4649 3.09278
70 2JLD AG1 0.01219 0.43677 3.09524
71 4EMV 0R9 0.004073 0.4438 3.09735
72 5LYH 7B8 0.006449 0.45037 3.10881
73 5VNF VAL THR SER VAL VAL 0.0007029 0.46752 3.18471
74 5UKL SIX 0.02488 0.41323 3.22581
75 2V77 PAY 0.01726 0.40666 3.23625
76 1VJY 460 0.0002048 0.53221 3.30033
77 1ZY5 ANP 0.01671 0.40825 3.30033
78 5EW9 5VC 0.004154 0.50265 3.32103
79 2A1L PCW 0.001422 0.49886 3.33333
80 5T8U LPA 0.001602 0.45678 3.33333
81 5DQ8 FLF 0.008017 0.43614 3.33333
82 2X4Z X4Z 0.01116 0.43942 3.37838
83 1ZNY GDP 0.00547 0.42032 3.38164
84 5JFL NAD 0.04143 0.40331 3.43511
85 4ZH7 FUC GAL NAG GAL FUC 0.01036 0.41168 3.49908
86 5ACM MBT 0.00253 0.42349 3.6036
87 5MJA 7O3 0.003926 0.43909 3.60656
88 3E7O 35F 0.004926 0.45667 3.61111
89 5LUN OGA 0.004642 0.42939 3.69318
90 5LUN ARG 0.01165 0.42939 3.69318
91 3T4L ZEA 0.0002998 0.50142 3.7037
92 2ZMF CMP 0.000685 0.48377 3.7037
93 3THR C2F 0.005318 0.43479 3.75427
94 2YKL NLD 0.0003135 0.49262 3.77358
95 1OUK 084 0.001326 0.53382 3.82514
96 4XCB HY0 0.01222 0.42796 3.83142
97 4XCB AKG 0.01064 0.40468 3.83142
98 2WEI VGG 0.0007373 0.40726 3.83275
99 3G5D 1N1 0.001134 0.51369 3.84615
100 5A89 FMN 0.003258 0.47923 3.84615
101 5A89 ADP 0.003258 0.47923 3.84615
102 5H9Q TD2 0.000672 0.40727 3.87097
103 4LOO SB4 0.0001537 0.5162 3.87812
104 2B3D FAD 0.01094 0.42957 3.92157
105 1KGI T4A 0.00008617 0.54028 3.93701
106 4YZC STU 0.02282 0.42423 3.95062
107 3MTX PGT 0.004956 0.45481 3.97351
108 5F7V GLC GLC GLC GLC 0.01235 0.42219 4
109 3CBC DBS 0.00007576 0.47752 4.0404
110 3IX8 TX3 0.0004535 0.5046 4.04624
111 3ACL 3F1 0.001343 0.46426 4.05405
112 5COU ATP 0.008624 0.42363 4.11765
113 2OVW CBI 0.01155 0.40416 4.13625
114 2RDQ AKG 0.004303 0.44586 4.16667
115 4UWJ 7L5 0.02045 0.4454 4.1769
116 4UWJ MYA 0.02045 0.4454 4.1769
117 4I53 1C1 0.01088 0.42305 4.18994
118 1ZB6 GST 0.00207 0.47192 4.23453
119 1ZB6 DIN 0.001945 0.47192 4.23453
120 1RE8 BD2 0.01827 0.43767 4.28571
121 2QCS ANP 0.01689 0.4219 4.28571
122 4WB6 ATP 0.02547 0.41212 4.28571
123 5IXH OTP 0.002244 0.48698 4.34783
124 4ZTD ALA GLY ALA GLY ALA 0.0009669 0.42959 4.34783
125 4WN5 MVC 0.02129 0.40989 4.34783
126 4MNS 2AX 0.001222 0.50566 4.40252
127 4TWP AXI 0.003136 0.4805 4.42804
128 2GU8 796 0.0194 0.44194 4.45104
129 5JKG 6LF 0.009643 0.44683 4.50161
130 5LRT ADP 0.002165 0.46526 4.52756
131 4I54 1C1 0.02118 0.41997 4.53258
132 4HIA FMN 0.001615 0.48647 4.54545
133 3E8T UQ8 0.0202 0.44246 4.54545
134 5DYO FLU 0.0008406 0.44397 4.58716
135 5HWV MBN 0.0008586 0.46129 4.61538
136 4TW7 37K 0.001588 0.47528 4.6875
137 5X8G S0N 0.04131 0.4199 4.74227
138 3KRR DQX 0.001078 0.52087 4.74576
139 1YKD CMP 0.005124 0.43618 4.77387
140 3ESS 18N 0.007184 0.40205 4.78261
141 5D3X 4IP 0.002343 0.43114 4.79042
142 5AIG VPR 0.003894 0.40083 4.8
143 2DQU CPD 0.01274 0.42782 4.91071
144 4L3L 5FI 0.01092 0.43497 4.93421
145 3RGA LSB 0.004649 0.4359 4.947
146 5UIU 8CG 0.0206 0.42107 4.95356
147 1JJE BYS 0.01956 0.40838 4.95496
148 3M3E GAL A2G NPO 0.001447 0.4091 4.96894
149 4P5Z Q7M 0.000689 0.51103 4.98615
150 4R38 RBF 0.00004677 0.54748 5
151 1Y2F WAI 0.002453 0.41209 5.03597
152 3EPO MP5 0.014 0.41638 5.06536
153 5ALC TIQ 0.02382 0.41616 5.12821
154 4H6Q TFB 0.04022 0.40223 5.12821
155 5HES 032 0.002232 0.46178 5.21173
156 4B7P 9UN 0.01957 0.43424 5.21739
157 4BTV RB3 0.008277 0.40969 5.23256
158 4A0M NAD 0.03543 0.40859 5.24194
159 2JDR L20 0.02474 0.43589 5.26316
160 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.02474 0.43589 5.26316
161 3MVH WFE 0.01608 0.42574 5.26316
162 4RT1 C2E 0.00196 0.45571 5.35714
163 3KH5 AMP 0.04458 0.41944 5.35714
164 5ECP ATP 0.02592 0.42786 5.38117
165 1ZM1 BGC BGC BGC 0.001732 0.45752 5.39419
166 4P8K FAD 0.00907 0.45953 5.41667
167 4P8K 38C 0.00907 0.45953 5.41667
168 5TV6 PML 0.01435 0.40241 5.41667
169 2HK5 1BM 0.004314 0.44539 5.55556
170 3KFF ZBT 0.003333 0.41895 5.55556
171 3KFF XBT 0.003333 0.41895 5.55556
172 2RDE C2E 0.003384 0.43826 5.57769
173 3N0Y APC 0.003569 0.45434 5.58659
174 2P1O NLA 0.01027 0.43647 5.625
175 2P1O IHP 0.01027 0.43647 5.625
176 2P1M IHP 0.01563 0.42211 5.625
177 4XYM A12 0.02005 0.40668 5.65217
178 4M1U MBG A2G 0.02608 0.40634 5.71429
179 1Y0G 8PP 0.00847 0.45485 5.75916
180 5UR1 YY9 0.005663 0.46417 5.78778
181 5BVE 4VG 0.0003716 0.54502 5.81717
182 4Y24 TD2 0.006353 0.42244 5.84416
183 3NCQ ATP 0.03167 0.40092 5.88235
184 5IXG OTP 0.00183 0.49465 5.91716
185 4K3H 1OM 0.00255 0.45601 5.9322
186 4HN1 TYD 0.01423 0.40555 5.97015
187 2CM4 RCL 0.008706 0.42972 6
188 4FG8 ATP 0.007634 0.43239 6.03175
189 1FDQ HXA 0.01708 0.41889 6.10687
190 5F3I 5UJ 0.002489 0.49142 6.11111
191 3LXK MI1 0.002246 0.47009 6.11621
192 4NFN 2KC 0.002689 0.44918 6.14887
193 4I8P NAD 0.02911 0.41543 6.15385
194 2GJ5 VD3 0.02119 0.4266 6.17284
195 5NCF 8T5 0.01131 0.40339 6.19469
196 5X7Q GLC GLC GLC GLC GLC 0.000392 0.4308 6.28492
197 5X7Q GLC GLC GLC GLC 0.0005479 0.4251 6.28492
198 3E85 BSU 0.00004046 0.58083 6.32911
199 4ZSI GLP 0.0006484 0.48064 6.43275
200 5J8O 6GZ 0.01284 0.41437 6.45161
201 1BW9 PPY 0.02054 0.40172 6.46067
202 1C1X HFA 0.01745 0.40323 6.47887
203 4USI ATP 0.01131 0.42439 6.49351
204 3OQJ 3CX 0.003935 0.43337 6.61479
205 2E5A LAQ 0.0007265 0.49728 6.62824
206 5ML3 DL3 0.02578 0.42323 6.71141
207 1UYY BGC BGC 0.004876 0.42115 6.87023
208 3AGC RCC 0.003293 0.46126 6.88406
209 1REQ DCA 0.002542 0.48483 6.90738
210 1ODM ASV 0.02876 0.40542 6.94864
211 5ENQ 5QE 0.03012 0.40605 7.06076
212 3TTZ 07N 0.001225 0.46071 7.07071
213 4NG2 OHN 0.000694 0.49304 7.07965
214 3QXV MTX 0.0226 0.40138 7.14286
215 2Z77 HE7 0.006595 0.43875 7.19424
216 4YLL 4E3 0.0306 0.40288 7.20222
217 3HKW IX6 0.01176 0.45279 7.22892
218 4B0T ADP 0.00158 0.47575 7.30223
219 2RKV ZBA 0.017 0.43295 7.31707
220 2RKV COA 0.01488 0.43295 7.31707
221 2XIQ MLC 0.001508 0.48259 7.40223
222 4P8O 883 0.01474 0.40139 7.48663
223 5F7N NAG GAL FUC FUC A2G 0.01968 0.41408 7.5
224 2P7Q GG6 0.01381 0.40024 7.5188
225 2J9D ADP 0.02524 0.40615 7.56302
226 2J9D AMP 0.02163 0.40445 7.56302
227 1LSH PLD 0.02284 0.4166 7.68156
228 4DE9 VTP 0.001881 0.47794 7.69231
229 5DEY 59T 0.005048 0.47404 7.74411
230 3FHI ANP 0.02776 0.40994 7.79221
231 2YNE YNE 0.0302 0.44546 7.8125
232 2YNE NHW 0.0302 0.44546 7.8125
233 4X6F 3XU 0.006264 0.458 7.82918
234 3NZ1 3NY 0.001922 0.41552 8.04598
235 5IQD GNP 0.04615 0.40705 8.19672
236 1KZN CBN 0.00375 0.44595 8.29268
237 1MDC PLM 0.0009208 0.48345 8.33333
238 4WVW SLT 0.0009931 0.445 8.33333
239 4BVA T3 0.004499 0.465 8.35821
240 5MW4 5JU 0.003552 0.47472 8.38323
241 4RYV ZEA 0.003469 0.43737 8.3871
242 3HXU A5A 0.001394 0.47314 8.39002
243 1TT8 PHB 0.001232 0.48116 8.53659
244 1QY1 PRZ 0.0002843 0.50781 8.62069
245 3ILR IXD 0.02017 0.43796 8.64865
246 3ILR SGN 0.02017 0.43796 8.64865
247 1GP6 SIN 0.01477 0.42134 8.70786
248 1GP6 DH2 0.01477 0.42134 8.70786
249 1MFI FHC 0.00699 0.40298 8.77193
250 4F4P 0SB 0.01303 0.45349 8.79121
251 1NCQ W11 0.001176 0.47095 8.82353
252 3WG3 A2G GAL NAG FUC 0.005378 0.423 8.98876
253 4QYN RTL 0.02512 0.40874 9.02256
254 2YG2 FLC 0.002526 0.46364 9.30233
255 2YG2 S1P 0.01789 0.41512 9.30233
256 3SAO DBH 0.0000132 0.48912 9.375
257 3SAO NKN 0.0007759 0.46957 9.375
258 5H9P TD2 0.00371 0.43077 9.49367
259 3FW4 CAQ 0.0004077 0.50524 9.55056
260 3ZXE PGZ 0.0003663 0.461 9.77444
261 1WW5 SGA BGC 0.007792 0.40962 10
262 5CJ3 52G 0.01175 0.43289 10.3704
263 3K3K A8S 0.01559 0.4146 10.4265
264 3DLG GWE 0.0029 0.49487 10.4545
265 5AXH GLC GLC GLC GLC 0.02498 0.40838 10.6796
266 3QRC SCR 0.00006524 0.42727 10.828
267 1CLU DBG 0.002166 0.48712 10.8434
268 2FB3 GTP 0.007906 0.43978 10.8824
269 5GLT BGC GAL NAG GAL 0.0008132 0.4185 10.9155
270 5J75 6GQ 0.0121 0.41181 10.9848
271 4L4V 1VY 0.003681 0.44551 11.1111
272 5U98 VAL THR THR ASP ILE GLN VAL LYS VAL 0.02473 0.41726 11.1111
273 5U98 1KX 0.03922 0.41555 11.1111
274 5C9J STE 0.02106 0.40782 11.1111
275 2WZ5 MET 0.0003352 0.40337 11.1111
276 5L2J 70E 0.003779 0.49113 11.2245
277 5L2J 6UL 0.003584 0.49113 11.2245
278 5DJT FMN 0.001942 0.45958 11.4754
279 1N07 FMN 0.003191 0.46879 11.6564
280 3H0L ADP 0.0004189 0.47997 11.7021
281 1ERB ETR 0.002248 0.46955 12.0219
282 2WSA MYA 0.02553 0.44798 12.1005
283 2WSA 646 0.02553 0.44798 12.1005
284 5JNN 6LM 0.01862 0.41512 12.6316
285 3A5Y KAA 0.01979 0.41582 14.4928
286 3DZ6 M8E 0.009824 0.42244 14.9254
287 1TMM APC 0.02831 0.41315 15.1899
288 1TMM HHR 0.02687 0.41315 15.1899
289 1ZT1 PHE GLU ALA ASN GLY ASN LEU ILE 0.02312 0.41941 16
290 3FON VAL ASN ASP ILE PHE GLU ALA ILE 0.0217 0.41874 16
291 5BYZ 4WE 0.01637 0.42573 16.092
292 3IWD M2T 0.003536 0.40437 16.129
293 1LEK GLU GLN TYR LYS PHE TYR SER VAL 0.04524 0.42679 16.1616
294 1MHC FME TYR PHE ILE ASN ILE LEU THR LEU 0.03467 0.41008 16.1616
295 1NB9 ADP 0.007174 0.45492 16.3265
296 1NB9 RBF 0.007174 0.45492 16.3265
297 3OJI PYV 0.018 0.41181 16.4021
298 5W10 CMP 0.006374 0.43331 16.4103
299 4XIZ LPP 0.004199 0.46031 17.1429
300 3BXO UPP 0.005673 0.43213 17.1548
301 5BU3 4W9 0.003043 0.45367 17.9348
302 2QK4 ATP 0.01435 0.40382 19.2478
303 3L9R L9Q 0.003674 0.46719 19.3878
304 3L9R L9R 0.007313 0.45073 19.3878
305 4F7E 0SH 0.01561 0.43738 19.3878
306 5VC5 96M 0.001382 0.48111 19.7232
307 1DR1 NAP 0.04792 0.40868 22.2222
308 1DR1 HBI 0.04792 0.40868 22.2222
Pocket No.: 6; Query (leader) PDB : 4WOE; Ligand: ADP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 4woe.bio2) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 4WOE; Ligand: 3S5; Similar sites found: 60
This union binding pocket(no: 7) in the query (biounit: 4woe.bio2) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4LY9 1YY 0.002523 0.46148 2.1978
2 4LY9 S6P 0.002366 0.46148 2.1978
3 1T36 U 0.00811 0.42869 2.35602
4 3KFC 61X 0.02115 0.4161 2.37154
5 4RGQ NDP 0.01438 0.41681 2.44565
6 4RGQ 13P 0.0245 0.41459 2.44565
7 4RGQ 1GP 0.02392 0.40973 2.44565
8 3TXO 07U 0.03538 0.41014 2.83286
9 2WOX NDP 0.03507 0.40752 2.86299
10 4CQE CQE 0.0287 0.41471 2.8777
11 4DVE BTN 0.009753 0.40013 3.0303
12 2JLD AG1 0.01085 0.41373 3.09524
13 4HGD KGT 0.009453 0.42478 3.22581
14 4LH0 GLV 0.01272 0.42312 3.37478
15 4J75 TYM 0.01209 0.43052 3.42298
16 1XK5 TPG 0.004928 0.40655 3.43137
17 1YP4 ADP 0.004238 0.43982 3.7694
18 1JCM 137 0.00578 0.43512 3.861
19 4CNG SAH 0.02081 0.40814 3.92157
20 5KBF CMP 0.01756 0.40098 3.98671
21 1NE6 SP1 0.02032 0.40418 4.24028
22 5TO8 7FM 0.01795 0.41709 4.25532
23 4WB6 ATP 0.02131 0.41826 4.28571
24 1RE8 BD2 0.04674 0.41156 4.28571
25 1BKC INN 0.02087 0.40037 4.29688
26 2ISJ FMN 0.0108 0.42846 4.34783
27 2GU8 796 0.03113 0.4319 4.45104
28 2Z3Y F2N 0.03917 0.40816 4.53172
29 2X5W K2B 0.007307 0.41542 4.77273
30 3NIM ARG ARG ALA ALA 0.009699 0.41289 4.87805
31 4FHD 0TT 0.0197 0.41692 4.8913
32 4FHD EEM 0.0197 0.41692 4.8913
33 5W4W 9WG 0.03684 0.41133 5.13595
34 5B4B LP5 0.01903 0.41468 5.24194
35 3MVH WFE 0.03544 0.40492 5.26316
36 5EPO TUD 0.007609 0.43655 5.34351
37 3KH5 AMP 0.0167 0.42735 5.35714
38 5ECP ATP 0.04276 0.40983 5.38117
39 5IXJ THR 0.02899 0.40058 5.55556
40 4RDZ MYR 0.01509 0.4003 5.6962
41 4LRL DGT 0.0187 0.40203 5.83333
42 4FG8 ATP 0.01253 0.4093 6.03175
43 4K37 SAM 0.01062 0.42415 6.21622
44 3KMR EQN 0.04203 0.40193 6.39098
45 4QWT ACD 0.007783 0.43364 6.46552
46 3MQG ACO 0.0382 0.42484 7.29167
47 3PNA CMP 0.006565 0.41903 7.79221
48 5L4L NAP 0.015 0.42518 7.89474
49 4BVA T3 0.04128 0.408 8.35821
50 4BVA NDP 0.03189 0.408 8.35821
51 5FYR INS 0.006016 0.40364 9.73154
52 5X8Q 82R 0.03432 0.40838 10.0775
53 3FAL LO2 0.02969 0.40433 10.1504
54 3AMN CBI 0.01319 0.41165 10.1887
55 3AMN CBK 0.01319 0.41165 10.1887
56 3ZX4 2M8 0.009263 0.42415 10.8108
57 3OCP CMP 0.00426 0.42525 11.5108
58 5NTW 98N 0.03512 0.40941 12.0623
59 2BKK ADP 0.01734 0.40412 15.1515
60 3KPB SAM 0.01572 0.40207 17.2131
Pocket No.: 8; Query (leader) PDB : 4WOE; Ligand: 3S5; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 4woe.bio2) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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