Receptor
PDB id Resolution Class Description Source Keywords
2Q28 1.74 Å EC: 4.1.1.8 CRYSTAL STRUCTURE OF OXALYL-COA DECARBOXYLASE FROM ESCHERICH COMPLEX WITH ADENOSINE-5`-DIPHOSPHATE ESCHERICHIA COLI LYASE; OXALYL-COA DECARBOXYLASE; OXALATE DEGRADATION; THIAMIDIPHOSPHATE LYASE
Ref.: NEW INSIGHTS INTO STRUCTURE-FUNCTION RELATIONSHIPS COA DECARBOXYLASE FROM ESCHERICHIA COLI. FEBS J. V. 277 2628 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:4003;
B:5003;
Valid;
Valid;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
EDO A:3001;
A:3003;
B:3002;
B:3004;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
MES A:4004;
B:5004;
Invalid;
Invalid;
none;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
MG A:1001;
B:1002;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
SO4 A:2001;
B:2002;
Invalid;
Invalid;
none;
none;
submit data
96.063 O4 S [O-]S...
TPP A:4001;
B:5001;
Valid;
Valid;
none;
none;
submit data
425.314 C12 H19 N4 O7 P2 S Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2Q28 1.74 Å EC: 4.1.1.8 CRYSTAL STRUCTURE OF OXALYL-COA DECARBOXYLASE FROM ESCHERICH COMPLEX WITH ADENOSINE-5`-DIPHOSPHATE ESCHERICHIA COLI LYASE; OXALYL-COA DECARBOXYLASE; OXALATE DEGRADATION; THIAMIDIPHOSPHATE LYASE
Ref.: NEW INSIGHTS INTO STRUCTURE-FUNCTION RELATIONSHIPS COA DECARBOXYLASE FROM ESCHERICHIA COLI. FEBS J. V. 277 2628 2010
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2Q29 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
2 2Q28 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
3 2Q27 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
70% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2Q29 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
2 2Q28 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
3 2Q27 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
4 2JI7 - OXT C34 H55 N11 O24 P5 S2 Cc1c(sc([n....
5 2JI9 - TPW C13 H19 N3 O7 P2 S Cc1c(csc1C....
6 2JI6 - OXK C23 H36 N7 O19 P3 S CC(C)(CO[P....
7 2JIB - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
8 2C31 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
9 2JI8 - FYN C22 H36 N7 O17 P3 S CC(C)(CO[P....
50% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2Q29 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
2 2Q28 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
3 2Q27 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
4 2JI7 - OXT C34 H55 N11 O24 P5 S2 Cc1c(sc([n....
5 2JI9 - TPW C13 H19 N3 O7 P2 S Cc1c(csc1C....
6 2JI6 - OXK C23 H36 N7 O19 P3 S CC(C)(CO[P....
7 2JIB - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
8 2C31 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
9 2JI8 - FYN C22 H36 N7 O17 P3 S CC(C)(CO[P....
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: TPP; Similar ligands found: 41
No: Ligand ECFP6 Tc MDL keys Tc
1 TPP 1 1
2 V4E 0.891892 1
3 TDP 0.84 0.985714
4 TPS 0.816901 0.957143
5 TMV 0.769231 0.958333
6 2TP 0.725 0.932432
7 VNP 0.721519 0.958904
8 VIB 0.621622 0.75
9 PYI 0.581395 0.887324
10 TDW 0.566667 0.972222
11 HTL 0.566667 0.958904
12 N1T 0.556818 0.985714
13 FTP 0.551724 0.835616
14 THV 0.548387 0.958904
15 TPW 0.546512 0.9
16 WWF 0.542553 0.933333
17 TD6 0.540816 0.921053
18 THY 0.536842 0.945946
19 TOG 0.536082 0.921053
20 TDL 0.53125 0.897436
21 THW 0.530612 0.958904
22 TD9 0.53 0.921053
23 TD8 0.53 0.921053
24 TDK 0.525773 0.921053
25 D7K 0.490566 0.909091
26 S1T 0.489362 0.887324
27 R1T 0.489362 0.887324
28 TPU 0.483146 0.842105
29 5SR 0.479167 0.945205
30 T5X 0.476636 0.897436
31 T6F 0.476636 0.897436
32 1U0 0.474227 0.84
33 8PA 0.459459 0.945946
34 TZD 0.451613 0.883117
35 O2T 0.45098 0.909091
36 TDM 0.443299 0.894737
37 TDN 0.415842 0.871795
38 THD 0.411765 0.839506
39 MP5 0.407895 0.676056
40 TD7 0.40566 0.85
41 DPX 0.4 0.734177
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2Q28; Ligand: TPP; Similar sites found: 114
This union binding pocket(no: 1) in the query (biounit: 2q28.bio1) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2E1A MSE 0.004817 0.41957 None
2 2AQJ TRP 0.003838 0.41025 1.11524
3 2AQJ FAD 0.004028 0.41025 1.11524
4 2QV7 ADP 0.001344 0.4226 1.78042
5 1MVN PCO 0.006892 0.40042 1.91388
6 3MAG 3MA 0.01989 0.43277 1.9544
7 2Q8H TF4 0.02538 0.41999 2.12766
8 1EYE PMM 0.00525 0.40887 2.14286
9 2ZWS PLM 0.005529 0.47244 2.16718
10 3A1I UNU 0.003817 0.41888 2.30326
11 1WDA BAG 0.007469 0.41165 2.30496
12 2IZ1 ATR 0.002246 0.45123 2.32068
13 1QZZ SAM 0.001652 0.42377 2.40642
14 1CKM GTP 0.003509 0.42529 2.42424
15 3RF4 FUN 0.01333 0.40567 2.58621
16 3GTD MLI 0.01236 0.41195 2.6971
17 4M5P MLA 0.02646 0.42604 2.7027
18 4M5P 23W 0.04181 0.40282 2.7027
19 1PVS 7HP 0.01438 0.40331 2.83688
20 1Q11 TYE 0.01468 0.40387 2.95699
21 1KTC NGA 0.01431 0.40434 3.01418
22 1XX4 BAM 0.01131 0.41116 3.06513
23 1G6H ADP 0.04467 0.40424 3.11284
24 1QD0 RR6 0.0003751 0.45364 3.125
25 1QDS PGA 0.007629 0.40675 3.18725
26 3ZPG 5GP 0.00211 0.4757 3.19149
27 1SS4 GSH 0.0005307 0.53615 3.26797
28 2BES RES 0.002268 0.42312 3.48837
29 3QV9 QV7 0.002292 0.44442 3.60721
30 1UF5 CDT 0.002108 0.42926 3.63036
31 1QO0 BMD 0.00199 0.45364 3.63636
32 1PEA ACM 0.01972 0.41916 3.63636
33 4COQ SAN 0.005443 0.4336 3.64372
34 1Y42 TYR 0.01452 0.40407 3.7234
35 1ZJ6 G3D 0.00185 0.42658 3.74332
36 2JBH 5GP 0.003102 0.42751 4
37 3AHC TPP 0.0003347 0.45128 4.07801
38 2OG2 MLI 0.02306 0.42175 4.25532
39 1T10 F6P 0.0107 0.41474 4.25532
40 2NCD ADP 0.0002366 0.48805 4.28571
41 4KCT FDP 0.007829 0.40207 4.40882
42 4KCT PYR 0.02979 0.40175 4.40882
43 1ITZ TPP 0.0005905 0.44199 4.43262
44 4DYO SD4 0.003181 0.42706 4.53608
45 2C5S AMP 0.002974 0.42827 4.60048
46 2XDQ MGX 0.01293 0.43516 4.69667
47 4E28 9MZ 0.02446 0.40355 4.92308
48 1JJ7 ADP 0.04392 0.40503 5
49 3SHR CMP 0.004346 0.41661 5.14184
50 3LTW HLZ 0.001873 0.45485 5.49645
51 2EB5 OXL 0.0126 0.41685 5.61798
52 1C1L GAL BGC 0.02296 0.41009 5.83942
53 3NOJ PYR 0.02217 0.4103 5.88235
54 3F81 STT 0.0001467 0.53516 6.01093
55 4E1M TQ2 0.0097 0.40254 6.0241
56 2O1S TDP 0.003618 0.43061 6.02837
57 4F8L GAL 0.009585 0.45896 6.2069
58 1YOA FMN 0.0004985 0.53123 6.28931
59 3QDT A2G GAL 0.007992 0.43862 6.29371
60 4IXW IXW 0.005056 0.4187 6.29921
61 2F01 BTQ 0.005387 0.40926 6.29921
62 3S9K CIT 0.002021 0.5098 6.77966
63 1WGC SIA GAL BGC 0.004402 0.46807 7.01754
64 2WGC SIA GAL BGC 0.0233 0.43712 7.01754
65 3JUC PCA 0.02789 0.40318 7.18954
66 1QS0 TDP 0.0004299 0.41908 7.39645
67 2J5V PCA 0.02094 0.43318 7.62943
68 2Q37 3AL 0.001121 0.45816 7.73481
69 3JQ3 ADP 0.008796 0.40426 7.9235
70 1T0S BML 0.005996 0.44479 8.13953
71 2EJU SAH 0.002719 0.40343 8.20106
72 1G8S MET 0.001896 0.4546 8.26087
73 3P7I P7I 0.01642 0.40176 8.41121
74 4HSE ADP 0.01826 0.40486 8.81612
75 1W7J ADP BEF 0.004293 0.40014 9.27152
76 1BTN I3P 0.01719 0.44737 9.43396
77 3UEC ALA ARG TPO LYS 0.01159 0.4243 9.58904
78 1H0C AOA 0.01508 0.41884 9.69388
79 2JFV FLC 0.008217 0.42539 9.96564
80 1ECM TSA 0.01104 0.40458 10.0917
81 3DVA TPW 0.003572 0.40693 10.1538
82 1W85 TDP 0.004553 0.41178 10.1852
83 4B9E FAH 0.0001742 0.51092 10.299
84 1I2L DCS 0.001904 0.40505 12.6394
85 1UMD TDP COI 0.001459 0.41943 12.6543
86 3EXH TPP 0.004021 0.41409 12.766
87 3BY8 MLT 0.006294 0.43693 13.3803
88 2AWN ADP 0.04073 0.4064 13.3858
89 4OHB 5HM 0.001253 0.42372 15.2632
90 2X7J TPP 0.000206 0.45302 16.844
91 1UO5 PIH 0.001831 0.49946 17.6471
92 4F4S EFO 0.00441 0.42631 19.7368
93 1ULE GLA GAL NAG 0.02157 0.41722 20
94 3KJQ B94 0.006858 0.40433 24.2105
95 1LNX URI 0.005347 0.42272 25.9259
96 1O9U ADZ 0.02725 0.41838 27.7778
97 1ZPD DPX 0.00001393 0.50509 35.5634
98 2VBF TPP 0.000008888 0.51292 35.8156
99 3FSJ D7K 0.00000001407 0.56127 37.1212
100 1V5F FAD 0.0000004445 0.61175 37.766
101 1V5F TPP 0.00001978 0.53153 37.766
102 2VK4 TPP 0.00001289 0.50057 38.1206
103 2IHT TPP 0.0005448 0.43633 38.3944
104 1UPA TPP 0.0005802 0.43525 38.3944
105 2NXW TPP 0.0003539 0.45328 38.4752
106 1YBH P22 0.000002813 0.59802 40.4255
107 3EYA TDP 0.00005731 0.47496 42.0765
108 4RJK TPP 0.00003709 0.46752 43.2574
109 4RJK TDL 0.00004324 0.45166 43.2574
110 4RJK PYR 0.01883 0.42016 43.2574
111 1T9D PYD 0.0006005 0.4769 43.617
112 1T9D P22 0.03372 0.42797 43.617
113 2UZ1 TPP 0.000002566 0.52825 46.0993
114 3IAE D7K 0.000002953 0.48647 46.0993
Pocket No.: 2; Query (leader) PDB : 2Q28; Ligand: ADP; Similar sites found: 614
This union binding pocket(no: 2) in the query (biounit: 2q28.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2E1A MSE 0.0001335 0.47392 None
2 2RGH FAD 0.0003568 0.44968 1.06383
3 2AQJ TRP 0.00005884 0.49537 1.11524
4 2AQJ FAD 0.00006212 0.49537 1.11524
5 3WO0 ADP 0.002502 0.41445 1.2766
6 3WO0 ALA 0.002502 0.41445 1.2766
7 2GVC FAD 0.009369 0.41049 1.34228
8 1SQF SAM 0.001204 0.43509 1.3986
9 3LAD FAD 0.004681 0.43369 1.47059
10 3VSE SAH 0.0011 0.403 1.50754
11 2BJK NAD 0.01309 0.40208 1.55039
12 3DMH SAM 0.002398 0.41229 1.5748
13 4MIG G3F 0.01405 0.41657 1.59574
14 3PT9 SAH 0.0006316 0.43769 1.60367
15 1CSI CMX 0.00194 0.4218 1.6092
16 1CSI OAA 0.00194 0.4218 1.6092
17 4AF0 IMP 0.009237 0.40432 1.61871
18 2BLE 5GP 0.01493 0.40371 1.63488
19 4D04 NAP 0.01692 0.42106 1.66052
20 3SSO SAH 0.002492 0.4119 1.67064
21 4K5S FAD 0.00007295 0.46517 1.6791
22 4K5S PM0 0.0002319 0.46517 1.6791
23 3GWT 066 0.0009044 0.42375 1.69972
24 2XVF FAD 0.002935 0.43783 1.72414
25 2XVE FAD 0.008432 0.41464 1.72414
26 3CH6 311 0.02015 0.41676 1.74825
27 4AT0 FAD 0.003185 0.42164 1.76471
28 3NTD FAD 0.00954 0.41553 1.77305
29 3NT6 FAD 0.02052 0.40026 1.77305
30 2QV7 ADP 0.001329 0.41371 1.78042
31 2WPF FAD 0.02215 0.42858 1.81818
32 2WPF WPF 0.04693 0.41313 1.81818
33 1GAD NAD 0.002729 0.40127 1.81818
34 3A4T SFG 0.001429 0.41571 1.82482
35 3C6K SPD 0.001045 0.45703 1.83727
36 2CKM AA7 0.002484 0.41998 1.84162
37 5H6S HDH 0.04933 0.4134 1.8711
38 1MVN FMN 0.001011 0.43094 1.91388
39 1MVN PCO 0.01096 0.40719 1.91388
40 2Q09 DI6 0.00278 0.4208 1.92308
41 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.008379 0.40712 1.92308
42 4J36 1HR 0.01359 0.41312 1.92771
43 4J36 FAD 0.008475 0.41245 1.92771
44 1RKD RIB 0.0009042 0.42514 1.94175
45 1RKD ADP 0.0009042 0.42514 1.94175
46 2RAB NAD 0.0152 0.42515 1.94384
47 2RAB FAD 0.007834 0.42515 1.94384
48 1VDC FAD 0.0004125 0.45483 1.95035
49 3ICS FAD 0.008196 0.41855 1.95035
50 4C4A SAH 0.002506 0.41763 1.95035
51 3ICR FAD 0.008791 0.41613 1.95035
52 3ICT FAD 0.01125 0.41124 1.95035
53 3MAG 3MA 0.007191 0.44841 1.9544
54 3MAG SAH 0.0007803 0.40891 1.9544
55 4N02 FNR 0.007601 0.41069 1.96078
56 1Q0H FOM 0.004167 0.41551 1.97044
57 1Q0H NDP 0.01151 0.40072 1.97044
58 1N4W FAD 0.009606 0.42014 1.98413
59 1U5R ATP 0.003126 0.40044 2.01149
60 3TKA SAM 0.001284 0.43189 2.01729
61 4TM3 FAD 0.02355 0.41699 2.0316
62 1G55 SAH 0.001073 0.43323 2.04082
63 1HDR NAD 0.004324 0.41752 2.04918
64 4OB6 S2T 0.001208 0.41519 2.05279
65 4HXY NDP 0.007489 0.41245 2.05479
66 2FR6 CTN 0.0008152 0.41242 2.05479
67 1R6D DAU 0.0001875 0.47155 2.07715
68 2EFJ SAH 0.003468 0.40404 2.08333
69 3PC3 P1T 0.001107 0.40591 2.08729
70 3T1A 5MA 0.0001567 0.42724 2.13144
71 1SOW NAD 0.001426 0.41818 2.13415
72 1EYE PMM 0.002023 0.41621 2.14286
73 2ZWS PLM 0.00801 0.45522 2.16718
74 1N1G BCP 0.005655 0.40062 2.18579
75 1LTH NAD 0.006631 0.41293 2.19436
76 4C12 ADP 0.002803 0.42711 2.19561
77 4ONQ SFG 0.003127 0.41716 2.2409
78 1FEC FAD 0.01186 0.41844 2.2449
79 1YS4 NAP 0.0007671 0.41313 2.25989
80 3K37 BCZ 0.00671 0.42582 2.267
81 1SB8 UD2 0.000269 0.46562 2.27273
82 1MO9 FAD 0.008024 0.44497 2.29446
83 1MO9 KPC 0.009328 0.44225 2.29446
84 3A1I UNU 0.0007557 0.43783 2.30326
85 1WDA BAG 0.001777 0.42864 2.30496
86 2BRY FAD 0.006528 0.41755 2.30496
87 4W6Z 8ID 0.004049 0.40694 2.30548
88 2AE2 PTO 0.0003904 0.44826 2.30769
89 2AE2 NAP 0.0075 0.42231 2.30769
90 1ELI PYC 0.01074 0.41318 2.31362
91 2IZ1 ATR 0.02167 0.40768 2.32068
92 2YHW BM3 0.0008389 0.42345 2.33236
93 4CCO OGA 0.01136 0.40069 2.35546
94 1XHL NDP 0.002337 0.43629 2.3569
95 4BJZ P3A 0.0005639 0.46591 2.35849
96 4BJZ FAD 0.0005639 0.46591 2.35849
97 1X87 NAD 0.0002003 0.47031 2.35935
98 4KRG SAH 0.0001732 0.45405 2.36052
99 2YX1 SFG 0.000843 0.41265 2.38095
100 4PLG OXM 0.0009943 0.43004 2.39521
101 4G87 UD1 0.002996 0.42129 2.39521
102 1XDS SAM 0.008765 0.40838 2.40642
103 1CKM GTP 0.00795 0.40238 2.42424
104 1TPY SAH 0.007388 0.40121 2.43902
105 1RP0 AHZ 0.002506 0.43912 2.46479
106 4PIO SAH 0.0003155 0.47793 2.47678
107 4PIO AVI 0.0005549 0.46555 2.47678
108 3EE4 MYR 0.0007881 0.4108 2.47678
109 3F3E LEU 0.0003001 0.44878 2.48227
110 4AZT SAM 0.0004474 0.44455 2.48227
111 2DKH FAD 0.01167 0.4062 2.48227
112 2DKH 3HB 0.01622 0.40592 2.48227
113 2AEB ABH 0.001017 0.42535 2.48447
114 4NAT ADP 0.02241 0.40691 2.5
115 2IMP NAI 0.01363 0.41461 2.50522
116 1A5Z OXM 0.01365 0.41923 2.50784
117 1U2Z SAH 0.006851 0.40426 2.54042
118 1Q3Q ANP 0.005755 0.41828 2.55474
119 2RDT 2RD 0.009606 0.41498 2.58398
120 2RDT FMN 0.006517 0.41474 2.58398
121 3CBG SAH 0.0004611 0.45765 2.58621
122 3RF4 FUN 0.003133 0.42405 2.58621
123 3T7S SAM 0.001239 0.42652 2.61194
124 4R33 SAH 0.004069 0.40336 2.61905
125 4R33 TRP 0.004069 0.40336 2.61905
126 1SNY NAP 0.0004138 0.42934 2.62172
127 1TUV VK3 0.01739 0.42077 2.63158
128 3OIG NAD 0.01141 0.40823 2.63158
129 3FC4 EDO 0.001733 0.43584 2.65957
130 3PFG SAM 0.00005289 0.4799 2.6616
131 2QCX PF1 0.00161 0.44224 2.6616
132 1GET NAP 0.007494 0.44134 2.66667
133 1GET FAD 0.00707 0.44134 2.66667
134 4M5P MLA 0.01035 0.44009 2.7027
135 4M5P 23W 0.007026 0.43318 2.7027
136 1P9B IMO 0.0006665 0.41884 2.71493
137 4I71 AGV 0.0001577 0.42809 2.72727
138 3MTW M3R 0.0002743 0.40883 2.72953
139 3FPZ AHZ 0.009487 0.42091 2.76074
140 2Y6Q FAD 0.01447 0.40084 2.76382
141 2Y6Q I7T 0.02803 0.40084 2.76382
142 3MPI GRA 0.001684 0.43632 2.77078
143 3IU9 T07 0.005762 0.41898 2.77778
144 1F3L SAH 0.000399 0.43763 2.80374
145 1WG8 SAM 0.001183 0.43888 2.80702
146 2IV2 MGD 0.0005704 0.46894 2.83688
147 2IV2 2MD 0.0007945 0.45581 2.83688
148 4IVG ANP 0.001649 0.43412 2.83688
149 1R27 MGD 0.01046 0.41164 2.83688
150 3JDW ORN 0.0003391 0.40813 2.83688
151 3U4C NDP 0.003836 0.42271 2.84698
152 1YB5 NAP 0.003039 0.40908 2.849
153 1RYI GOA 0.0001189 0.47063 2.87958
154 1RYI FAD 0.0004608 0.44894 2.87958
155 3DGB MUC 0.001502 0.42111 2.87958
156 2QQF A1R 0.00000007346 0.55532 2.92208
157 2OD9 A1R NCA 0.00004335 0.51027 2.92208
158 1V59 FAD 0.001174 0.46445 2.92887
159 3SQP FAD 0.02755 0.4404 2.92887
160 4DEM YS4 0.007079 0.42706 2.93333
161 3GD4 NAD 0.02149 0.42167 2.93542
162 3GD4 FAD 0.007528 0.4192 2.93542
163 1XE7 GUN 0.02372 0.41393 2.95567
164 1Q11 TYE 0.001058 0.44368 2.95699
165 4AZW SAM 0.0003238 0.45523 2.9724
166 2F2U M77 0.0004487 0.44667 2.98507
167 1TUF AZ1 0.002139 0.4017 2.99539
168 2GDZ NAD 0.006061 0.41526 2.99625
169 4POO SAM 0.003913 0.41638 3
170 1KTC NGA 0.001961 0.43252 3.01418
171 4CNK FAD 0.004674 0.4297 3.01418
172 3NDJ SAH 0.01262 0.41717 3.01418
173 1Y8Q ATP 0.001153 0.40971 3.01418
174 2O2C G6Q 0.002955 0.40131 3.01418
175 2ZIF SAM 0.0002772 0.45809 3.0303
176 1SZD APR 0.00004599 0.40652 3.0303
177 3A2Q ACA ACA 0.0008086 0.402 3.0426
178 1XX4 BAM 0.00725 0.43993 3.06513
179 2X61 CH 0.004468 0.40862 3.10078
180 2X61 NGA GAL SIA 0.0166 0.4006 3.10078
181 2YYJ FAD 0.01417 0.41495 3.1185
182 2YYJ 4HP 0.01417 0.41495 3.1185
183 1QD0 RR6 0.001025 0.4274 3.125
184 2V3A FAD 0.01298 0.4094 3.125
185 1MXI SAH 0.001432 0.40415 3.125
186 1QDS PGA 0.001751 0.42358 3.18725
187 3ZPG 5GP 0.001799 0.47035 3.19149
188 2ZWA SAH 0.003934 0.41296 3.19149
189 1NHZ 486 0.001314 0.40532 3.21429
190 1FP1 SAH 0.002758 0.40244 3.22581
191 3CQD ATP 0.001344 0.42532 3.23625
192 4FC7 NAP 0.01772 0.40688 3.2491
193 2P8B NSK 0.03325 0.4084 3.25203
194 1SS4 GSH 0.001792 0.49866 3.26797
195 1SS4 CIT 0.02976 0.41354 3.26797
196 1WXI AMP 0.001818 0.42282 3.27273
197 4TMK T5A 0.04643 0.40338 3.28639
198 4KQL 1SG 0.01145 0.40949 3.28947
199 1LC8 33P 0.001631 0.40893 3.2967
200 1UAY ADN 0.004156 0.42339 3.30579
201 3R35 4CO 0.00326 0.40423 3.31126
202 3GE7 AFQ 0.001284 0.4211 3.36788
203 4CS4 ANP 0.002312 0.41683 3.36879
204 4CS4 AXZ 0.003422 0.41683 3.36879
205 1V7R CIT 0.03504 0.41203 3.36879
206 4CMF PXG 0.007678 0.40896 3.36879
207 4OYA 1VE 0.02283 0.41286 3.40426
208 1I36 NAP 0.002059 0.40057 3.40909
209 3U31 NAD 0.0001862 0.49068 3.44828
210 1H6C NDP 0.003447 0.41057 3.4642
211 2NVK FAD 0.00008675 0.4733 3.48361
212 2V5E SCR 0.002924 0.46895 3.5
213 5E8J SAH 0.03863 0.40315 3.5461
214 3IHG FAD 0.003902 0.42238 3.5514
215 4NAE 1GP 0.02726 0.4065 3.55556
216 2J07 FAD 0.001578 0.43395 3.57143
217 2J07 HDF 0.001578 0.43395 3.57143
218 1ME8 RVP 0.001846 0.4493 3.57853
219 3DUW SAH 0.0004275 0.45013 3.58744
220 1H82 GZZ 0.001991 0.43819 3.60169
221 1H82 FAD 0.001738 0.43819 3.60169
222 3QV9 QV7 0.007902 0.41245 3.60721
223 3FSY SCA 0.005138 0.40378 3.61446
224 1UF5 CDT 0.0009179 0.43453 3.63036
225 1PEA ACM 0.001623 0.46386 3.63636
226 1QO0 BMD 0.006329 0.42233 3.63636
227 4KIB SAH 0.0007173 0.42962 3.64146
228 4COQ SAN 0.001062 0.45695 3.64372
229 4CKU P2F 0.001708 0.43176 3.64742
230 4EMJ FAD 0.003002 0.43955 3.65854
231 3T31 FAD 0.02748 0.40634 3.66133
232 3T31 DCQ 0.02928 0.40634 3.66133
233 1P77 ATR 0.02737 0.40022 3.67647
234 2QXX TTP 0.002481 0.41516 3.68421
235 1IM8 SAI 0.001642 0.41917 3.68852
236 1EDO NAP 0.005933 0.4182 3.68852
237 1Z3C SA8 0.001864 0.43797 3.69128
238 4RPM HXC 0.02798 0.4251 3.69458
239 1A59 COA 0.0008541 0.40344 3.7037
240 1Y42 TYR 0.00009036 0.48815 3.7234
241 3WE0 FAD 0.002571 0.42141 3.7234
242 1QO8 FAD 0.01405 0.41158 3.7234
243 2RGO FAD 0.01402 0.40687 3.7234
244 3P3N AKG 0.006618 0.42147 3.72493
245 2GSD NAD 0.002333 0.41437 3.73134
246 1K97 CIR 0.006137 0.42955 3.73626
247 1K97 ASP 0.006137 0.42955 3.73626
248 1ZJ6 G3D 0.001006 0.4277 3.74332
249 1TDF FAD 0.002942 0.42204 3.79747
250 1TDF NAP 0.007318 0.42204 3.79747
251 2G86 UMP 0.005882 0.4125 3.79747
252 4BLW AMP 0.01229 0.40631 3.80623
253 3SFI 3SF 0.00057 0.44227 3.81356
254 3VC1 SAH 0.002376 0.40382 3.84615
255 1RYD NDP 0.001213 0.42692 3.87597
256 4USQ FAD 0.01321 0.40489 3.87812
257 1SAY PYR 0.01382 0.404 3.87812
258 4NTC FAD 0.02066 0.40289 3.8806
259 4KXQ APR 0.00001362 0.49623 3.91459
260 2ZB3 NDP 0.0003606 0.43467 3.96601
261 2JBH 5GP 0.00615 0.40688 4
262 2JJQ SAH 0.01207 0.40194 4
263 2E5V FAD 0.01714 0.40842 4.02542
264 2VDV SAM 0.004456 0.42199 4.06504
265 4EUE NAI 0.00577 0.41874 4.06699
266 3TKY SAH 0.002778 0.41574 4.07609
267 1C3V NDP 0.0008694 0.42435 4.08163
268 3QVL 5HY 0.01038 0.40479 4.08163
269 2XYQ SAH 0.0004555 0.44457 4.09836
270 3S5W FAD 0.003792 0.42561 4.10367
271 3L9W GSH 0.0002308 0.47653 4.11622
272 3L9W AMP 0.0002772 0.47614 4.11622
273 4O1M NAD 0.0007528 0.42509 4.12698
274 1A27 NAP 0.001786 0.41201 4.15225
275 1Y9Q MED 0.0009288 0.45955 4.16667
276 2YVF FAD 0.004637 0.42402 4.16667
277 2YVF NAD 0.0259 0.41146 4.16667
278 4B4D FAD 0.0007375 0.41175 4.19847
279 2IVF MGD 0.002208 0.44457 4.20561
280 1I2B UPG 0.0008248 0.44893 4.20792
281 1I2B USQ 0.0008248 0.44893 4.20792
282 1I2B NAD 0.01636 0.41714 4.20792
283 1SQ5 ADP 0.0008027 0.43142 4.22078
284 1G6O ADP 0.00104 0.41399 4.24242
285 1JG3 ADN 0.000731 0.44444 4.25532
286 1JIL 485 0.0002414 0.42566 4.25532
287 1T10 F6P 0.004401 0.42342 4.25532
288 3X0D SAH 0.006019 0.40151 4.25532
289 2PP3 LGT 0.004066 0.40042 4.27136
290 2NCD ADP 0.0005317 0.46296 4.28571
291 3ICC NAP 0.001968 0.41324 4.31373
292 1D3V ABH 0.001002 0.41454 4.33437
293 1DJL NAP 0.000003189 0.44754 4.34783
294 2XK9 XK9 0.002736 0.4107 4.34783
295 1MOQ GLP 0.0006234 0.40808 4.34783
296 2HVW DDN 0.0003127 0.40584 4.34783
297 2ALG DAO 0.00124 0.40427 4.34783
298 2ALG HP6 0.00124 0.40427 4.34783
299 1C0I FAD 0.0000204 0.50128 4.40771
300 1C0I BE2 0.0000204 0.50128 4.40771
301 4KCT FDP 0.0005246 0.43841 4.40882
302 1M2K APR 0.000006887 0.47123 4.41767
303 3PJU C2E 0.001503 0.41015 4.41767
304 4MP8 NAD 0.001436 0.42429 4.42478
305 4MP8 MLI 0.001436 0.42429 4.42478
306 1D4D FAD 0.005389 0.4318 4.43262
307 2YB9 HA0 0.002209 0.40879 4.43262
308 1RZM PEP 0.002013 0.43205 4.43787
309 1RZM E4P 0.01629 0.40945 4.43787
310 1VR0 3SL 0.00005982 0.40567 4.45344
311 1V6A TRE 0.005388 0.43905 4.51807
312 1O97 AMP 0.00004952 0.5378 4.54545
313 1LDM NAD 0.01301 0.40859 4.55927
314 2Y7P SAL 0.001347 0.43932 4.58716
315 2C5S AMP 0.002174 0.42511 4.60048
316 4O8A FAD 0.0000441 0.4697 4.60993
317 1TIW FAD 0.001992 0.42029 4.60993
318 1TIW TFB 0.001992 0.42029 4.60993
319 2WK1 SAH 0.0035 0.41335 4.60993
320 2VPY MGD 0.007382 0.43916 4.61538
321 2QLX RM4 0.02457 0.40111 4.62963
322 3ZS7 ATP 0.001211 0.40651 4.66667
323 1E7S NAP 0.004115 0.40195 4.6729
324 3G2O SAM 0.004084 0.41215 4.68227
325 2F5Z FAD 0.002428 0.44785 4.6875
326 2XDQ MGX 0.0003985 0.5032 4.69667
327 4HA6 FAD 0.001013 0.43633 4.72441
328 1S7G NAD 0.00001024 0.53979 4.74308
329 1S7G APR 0.0000241 0.52657 4.74308
330 1GSA GSH 0.0002348 0.42162 4.74684
331 1GSA ADP 0.007204 0.40837 4.74684
332 4G1V FAD 0.0327 0.40515 4.7619
333 1T8U UAP SGN IDS SGN 0.004796 0.40646 4.77941
334 1ZK4 AC0 0.006385 0.42779 4.78088
335 1ZK4 NAP 0.006385 0.42779 4.78088
336 3Q9T FAY 0.005697 0.42578 4.78723
337 2OBF F83 0.01204 0.41468 4.84429
338 3GEG NAD 0.003765 0.42165 4.8583
339 1V35 NAI 0.003811 0.41316 4.86322
340 2CDU FAD 0.001695 0.44751 4.86726
341 1KPH SAH 0.005724 0.40597 4.87805
342 1D4O NAP 0.000002184 0.49264 4.8913
343 1QAN SAH 0.000531 0.43374 4.91803
344 3O7B SAH 0.0002688 0.41978 4.91803
345 2FWP ICR 0.002261 0.41485 4.91803
346 3WBF API 0.002963 0.40825 4.91803
347 3WBF NAP 0.002535 0.40531 4.91803
348 4E28 9MZ 0.006157 0.42287 4.92308
349 4E28 0MZ 0.01439 0.40118 4.92308
350 2DTX BMA 0.02137 0.40039 4.92424
351 2O07 MTA 0.0007044 0.40045 4.93421
352 1G0N PHH 0.01695 0.40688 4.947
353 2X1L MET 0.02215 0.40536 4.96183
354 1YXM ADE 0.001224 0.4755 4.96454
355 1DMR PGD 0.002087 0.46772 4.96454
356 3UCL CYH 0.01008 0.43323 4.96454
357 3UCL NAP 0.01098 0.43323 4.96454
358 1EJ0 SAM 0.001239 0.42587 5
359 3B20 NAD 0.001079 0.41345 5.01475
360 1DL5 SAH 0.001054 0.44436 5.04732
361 2YIP YIO 0.006028 0.42662 5.07246
362 1O7N IND 0.0007814 0.41286 5.12249
363 3H8V ATP 0.004601 0.4029 5.13699
364 3SHR CMP 0.001196 0.43005 5.14184
365 1ZQ9 SAM 0.00003658 0.50061 5.26316
366 2YC5 6BC 0.0008191 0.43061 5.26316
367 2AG5 NAD 0.01186 0.4023 5.28455
368 2PT9 2MH 0.0005823 0.46596 5.29595
369 2PT9 S4M 0.0003335 0.46446 5.29595
370 4IAE 1DX 0.008168 0.40988 5.31915
371 1QF5 GDP 0.00266 0.42457 5.33643
372 1QF5 RPL 0.00266 0.42457 5.33643
373 1XKQ NDP 0.008499 0.4124 5.35714
374 4M51 BEZ 0.001451 0.4662 5.38642
375 2BNE U5P 0.002688 0.41036 5.39419
376 9LDT NAD 0.001727 0.4139 5.42169
377 9LDB NAD 0.003667 0.40243 5.42169
378 3GRU AMP 0.0003969 0.45754 5.42373
379 2FKA BEF 0.04241 0.42429 5.42636
380 1FIQ SAL 0.003753 0.40336 5.42857
381 3LST SAH 0.007819 0.41467 5.45977
382 2AOT SAH 0.002789 0.40446 5.47945
383 3UXL CFI 0.01945 0.41225 5.48303
384 4DQ2 BTX 0.0003495 0.43514 5.4878
385 3LTW HLZ 0.0009157 0.45982 5.49645
386 2Z9C DTC 0.002012 0.40423 5.5
387 4I5I NAD 0.000007611 0.5399 5.57491
388 2EB5 OXL 0.001112 0.45605 5.61798
389 3QOX SAH 0.006606 0.40494 5.6338
390 3RO7 TDR 0.001965 0.40768 5.66038
391 1XHC FAD 0.001585 0.44884 5.72207
392 2PWY SAH 0.002021 0.42712 5.81395
393 1C1L GAL BGC 0.02453 0.40115 5.83942
394 2Z9V PXM 0.003664 0.42121 5.86735
395 3HVJ 705 0.000754 0.46467 5.88235
396 2HGZ PBF 0.0003098 0.4301 5.88235
397 4KQI NIO 0.0002964 0.44072 5.89888
398 4KQI RBZ 0.0002964 0.44072 5.89888
399 3C3Y SAH 0.00109 0.43293 5.90717
400 2GMM MAN MAN 0.01423 0.41573 5.95238
401 2PHT MAN MAN MAN 0.02087 0.40784 5.95238
402 3GXO SAH 0.002523 0.43341 5.96206
403 1FP2 SAH 0.000005324 0.45843 5.96591
404 3OBT SLB 0.02484 0.41519 5.99078
405 3F81 STT 0.001253 0.47823 6.01093
406 1FW1 GSH 0.00009232 0.46086 6.01852
407 3OFK SAH 0.00144 0.4165 6.01852
408 3LXD FAD 0.008714 0.41417 6.0241
409 2NLI LAC 0.003782 0.42055 6.02837
410 2NLI FMN 0.003782 0.42055 6.02837
411 1JQ5 NAD 0.02871 0.41672 6.02837
412 1P1C SAH 0.0007225 0.44634 6.03015
413 3AD8 NAD 0.004778 0.42483 6.06061
414 3AD8 FAD 0.02671 0.41317 6.06061
415 1GV0 NAD 0.001594 0.41374 6.12903
416 3VYW SAM 0.001682 0.41867 6.16883
417 4F8L GAL 0.002811 0.48031 6.2069
418 2P2V CSF 0.009825 0.40491 6.25
419 2HNK SAH 0.0002938 0.45915 6.27615
420 3QDT A2G GAL 0.01018 0.4254 6.29371
421 3QWI CUE 0.01506 0.40927 6.2963
422 3QWI NAP 0.009393 0.40927 6.2963
423 2VEZ ACO 0.001833 0.41019 6.31579
424 2WMO GTP 0.004168 0.40003 6.31579
425 3CKJ CIT 0.0005824 0.42426 6.38298
426 3LCC SAH 0.001785 0.41503 6.38298
427 4KCF AKM 0.003309 0.42273 6.38767
428 4KCF FMN 0.003592 0.40993 6.38767
429 2H6B 3C4 0.00134 0.44091 6.4
430 1E4E ADP 0.0002309 0.42209 6.41399
431 1WNG SAH 0.0007603 0.40928 6.41509
432 1D6H COA 0.004268 0.41329 6.45995
433 4TQG NDP 0.005527 0.4157 6.50155
434 1P9P SAH 0.0007814 0.41286 6.51341
435 4A6D SAM 0.00422 0.40805 6.51558
436 2XD9 XD9 0.0296 0.41805 6.58683
437 1I0Z OXM 0.006155 0.44351 6.60661
438 4DMG SAM 0.0007226 0.46363 6.61578
439 1V8B NAD 0.01724 0.40175 6.68058
440 4Q3R XA2 0.002296 0.40228 6.75325
441 3S9K CIT 0.00003802 0.59391 6.77966
442 1RM4 NDP 0.0001064 0.44956 6.82493
443 3NUG NAD 0.005923 0.41699 6.88259
444 1SG4 CO8 0.002966 0.40003 6.92308
445 3DAG FEG 0.0006863 0.42015 6.98324
446 2DPM SAM 0.002465 0.42166 7.04225
447 4A8T PAO 0.004928 0.42369 7.07965
448 1LCP PLU 0.002374 0.40179 7.0922
449 2UYQ SAM 0.01328 0.41694 7.09677
450 2GAG NAD 0.005566 0.42518 7.14286
451 1DLJ UGA 0.004497 0.41771 7.21393
452 1DLJ NAI 0.004497 0.41771 7.21393
453 1JQI FAD 0.0008785 0.43077 7.2165
454 1JQI CAA 0.002092 0.40203 7.2165
455 1M5B BN1 0.00574 0.41832 7.22433
456 2EG5 SAH 0.002845 0.431 7.25806
457 1NVU GTP 0.001744 0.43655 7.2695
458 1DRV A3D 0.0076 0.40749 7.32601
459 3JWH SAH 0.0005639 0.41777 7.37327
460 3I0O ADP 0.00265 0.41655 7.37463
461 3I0O SMI 0.0149 0.40053 7.37463
462 2E2R 2OH 0.003992 0.40486 7.37705
463 3HY3 10F 0.001725 0.40316 7.38916
464 1FL2 FAD 0.0205 0.40123 7.41935
465 1OFH ADP 0.001747 0.40632 7.47126
466 1R18 SAH 0.0007158 0.44465 7.48899
467 1DXY NAD 0.02261 0.41047 7.50751
468 3A25 SAM 0.001455 0.43152 7.6412
469 3FS8 ACO 0.03487 0.40005 7.69231
470 2Q37 3AL 0.007127 0.41438 7.73481
471 2OFE NAG 0.003583 0.43338 7.74648
472 3GU3 SAH 0.0001212 0.43172 7.74648
473 1PR9 NAP 0.003575 0.42929 7.78689
474 3D3W NAP 0.005164 0.41964 7.78689
475 3ZOD HQE 0.0003082 0.43373 7.8534
476 3ZOD FMN 0.0003082 0.43373 7.8534
477 1I9G SAM 0.002543 0.41926 7.85714
478 2R40 20E 0.001469 0.40723 7.89474
479 2WUF KEM 0.0005131 0.42086 7.90378
480 3JQ3 ADP 0.003245 0.41311 7.9235
481 4NEC SAH 0.004728 0.4168 7.95455
482 1I1N SAH 0.0003673 0.46603 7.9646
483 2A14 SAH 0.004591 0.41008 7.98479
484 1JNR FAD 0.02106 0.42211 8
485 3G89 SAM 0.00196 0.43848 8.03213
486 1EP2 ORO 0.0007829 0.43003 8.04598
487 1EP2 FMN 0.0007642 0.42182 8.04598
488 1IYE PGU 0.0004224 0.43533 8.09062
489 1Q0S SAH 0.008021 0.40286 8.10811
490 1T0S BML 0.003911 0.44545 8.13953
491 1EU1 MGD 0.001257 0.45459 8.15603
492 2EJU SAH 0.001768 0.42788 8.20106
493 2P3V SRT 0.02087 0.40592 8.20312
494 1G8S MET 0.00169 0.44795 8.26087
495 5MF6 AR6 0.005481 0.40421 8.27815
496 5MF6 7M2 0.005481 0.40421 8.27815
497 1PS9 FAD 0.006401 0.42645 8.33333
498 1L1E SAH 0.006046 0.40477 8.36237
499 4A3R CIT 0.005799 0.40023 8.37209
500 3P7I P7I 0.0007926 0.4489 8.41121
501 3ZG6 APR 0.000003786 0.53955 8.44595
502 4FZV SAM 0.003649 0.41258 8.78661
503 1NV8 MEQ 0.0008979 0.44899 8.80282
504 1NV8 SAM 0.0009728 0.44899 8.80282
505 1KYV RBF 0.0008204 0.40036 8.80503
506 1G60 SAM 0.0006602 0.44214 8.84615
507 2FEQ 34P 0.0006048 0.40472 8.88031
508 3B1F NAD 0.0003944 0.42277 8.96552
509 1YRX FMN 0.0003775 0.43324 9.09091
510 4NTD FAD 0.003172 0.43739 9.11765
511 3KMT SAH 0.004052 0.40048 9.2437
512 1W7J ADP BEF 0.000472 0.42498 9.27152
513 4QED NAP 0.00754 0.41105 9.27419
514 2Q1S NAI 0.02022 0.40507 9.28382
515 1BTN I3P 0.00009813 0.57142 9.43396
516 2AG8 NAP 0.004088 0.41048 9.5057
517 1DR1 HBI 0.0002298 0.45295 9.52381
518 1DR1 NAP 0.0002298 0.45295 9.52381
519 3UEC ALA ARG TPO LYS 0.0007338 0.47191 9.58904
520 2YY7 NAD 0.01057 0.40576 9.61539
521 3DXY SAM 0.006921 0.41718 9.63303
522 1H0C AOA 0.001998 0.45177 9.69388
523 2VBQ BSJ 0.005163 0.40088 9.69697
524 2HMT NAI 0.0002606 0.46342 9.72222
525 2JFV FLC 0.00189 0.44578 9.96564
526 2A0W DIH 0.004564 0.4022 10.0346
527 2FK8 SAM 0.004118 0.4037 10.0629
528 4BMO FMN 0.002576 0.40058 10.084
529 1ECM TSA 0.001697 0.42945 10.0917
530 3ZLM ANP 0.0008872 0.40243 10.1064
531 4OBW SAM 0.0004974 0.45167 10.1167
532 3PLN U5P 0.001863 0.43345 10.1415
533 3EGI ADP 0.00002966 0.55182 10.1942
534 3TCT 3MI 0.01447 0.40005 10.2362
535 4E13 NAD 0.0004266 0.41963 10.2473
536 3A27 SAM 0.001204 0.43508 10.2941
537 4B9E FAH 0.0006565 0.47415 10.299
538 1NM5 NAD 0.00002771 0.54677 10.3448
539 1NM5 NAP 0.00002633 0.54677 10.3448
540 4QTU SAM 0.001535 0.42665 10.3704
541 3GGO NAI 0.01496 0.41031 10.5096
542 1T26 NAI 0.003668 0.44367 10.559
543 1T26 GBD 0.003668 0.44367 10.559
544 1X1T NAD 0.02223 0.40291 10.7692
545 1EZV SMA 0.002222 0.40433 10.9091
546 3NCQ ATP 0.0004789 0.41796 10.9244
547 2HV8 GTP 0.001027 0.4125 10.9375
548 4KRI SAH 0.001133 0.43422 11.0855
549 3BGD PM6 0.008377 0.40637 11.1538
550 3BGD SAH 0.006556 0.40508 11.1538
551 4IWN GEK 0.001046 0.43942 11.3537
552 2G5C NAD 0.006871 0.41284 11.3879
553 4M37 SAH 0.005229 0.4041 11.6618
554 1PNO NAP 0.000009173 0.54012 11.6667
555 2WSB NAD 0.003076 0.44011 11.811
556 1HFS L04 0.002781 0.40795 11.875
557 3CF6 SP1 0.00009012 0.45545 11.976
558 4II2 ATP 0.005046 0.40658 12.0482
559 2OOR TXP 0.000005597 0.47237 12.069
560 2PXX SAH 0.002942 0.41468 12.093
561 1ZEM NAD 0.009175 0.40325 12.2137
562 1GS5 NLG 0.003963 0.40377 12.4031
563 1GS5 ANP 0.003963 0.40377 12.4031
564 1S8F GDP 0.002298 0.40383 12.4294
565 1I2L DCS 0.0009413 0.40623 12.6394
566 1WY7 SAH 0.0005786 0.4486 13.0435
567 1Z44 NPO 0.007314 0.4574 13.3136
568 3BY8 MLT 0.001127 0.46328 13.3803
569 1JYQ MAZ PTR PTM ASN 0.006025 0.41293 13.5417
570 3PNL ADP 0.0008107 0.41232 13.7255
571 3BXO SAM 0.0006142 0.42164 13.8075
572 1TU3 GNP 0.001863 0.40537 14.0351
573 2PY4 DUP 0.004681 0.4084 14.3678
574 3GDH SAH 0.0004554 0.42099 14.5228
575 4FR3 0V4 0.009796 0.41645 14.9573
576 4FR3 LYS ARG ARG LYS SEP VAL 0.01218 0.41271 14.9573
577 2GJ3 FAD 0.0199 0.40697 15
578 1NW5 SAM 0.006007 0.40155 15.047
579 3FUU ADN 0.0003732 0.45263 15.1292
580 4OHB 5HM 0.02613 0.41881 15.2632
581 1KBI PYR 0.001084 0.41502 15.4599
582 1KBI FMN 0.001084 0.41502 15.4599
583 1E6E FAD 0.01067 0.41126 15.625
584 1NVV GNP 0.002022 0.40416 15.6627
585 1L2T ATP 0.001509 0.40511 15.7447
586 1L3I SAH 0.0001104 0.48716 16.6667
587 1YAG ATP 0.0002182 0.43334 16.8
588 3OID NDP 0.0043 0.42569 17.4419
589 4K30 NLG 0.006586 0.41059 17.5
590 1UO5 PIH 0.04344 0.41439 17.6471
591 4BUZ OCZ 0.000008233 0.54401 17.8862
592 4BUZ OAD 0.000008233 0.54401 17.8862
593 4BUZ NAD 0.000006134 0.54401 17.8862
594 1YC5 NCA 0.00007466 0.49639 17.8862
595 4F4S EFO 0.00105 0.44381 19.7368
596 1ULE GLA GAL NAG 0.01228 0.42146 20
597 4NM5 ADP 0.0009132 0.4106 20.8333
598 1LSS NAD 0.00006702 0.48646 21.4286
599 4GQB 0XU 0.00563 0.40953 22.7273
600 4M38 SAH 0.003437 0.40622 23.8095
601 1QPB TPP 0.0004042 0.42969 24.4681
602 1QPB PYM 0.0004259 0.42892 24.4681
603 1LNX URI 0.01124 0.40088 25.9259
604 1O9U ADZ 0.002449 0.46363 27.7778
605 1QJC PNS 0.00895 0.40837 29.7468
606 3FSJ D7K 0.007113 0.42133 37.1212
607 1V5F TPP 0.000001864 0.60002 37.766
608 1V5F FAD 0.00005371 0.54239 37.766
609 2NXW TPP 0.004333 0.40116 38.4752
610 1YBH FAD 0.00000004272 0.46886 40.4255
611 3EYA FAD 0.00002288 0.53069 42.0765
612 2FYU FDN 0.0006991 0.41467 42.3077
613 4RJK PYR 0.0139 0.41886 43.2574
614 1T9D FAD 0.00000001343 0.47971 43.617
615 4GYW UDP 0.0002055 0.4478 50
Pocket No.: 3; Query (leader) PDB : 2Q28; Ligand: TPP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 2q28.bio1) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2Q28; 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: 2q28.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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