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Receptor
PDB id Resolution Class Description Source Keywords
2E2P 2 Å EC: 2.7.1.1 CRYSTAL STRUCTURE OF SULFOLOBUS TOKODAII HEXOKINASE IN COMPLEX WITH ADP SULFOLOBUS TOKODAII ACETATE AND SUGAR KINASES/HSP70/ACTIN SUPERFAMILY RIBONUCLEASE-H FOLD SUGAR KINASE GLUCOSE N- ACETYLGLUCOSAMINEHEXOKINASE CONFORMATIONAL CHANGE PHOSPHORYL TRANSFER TRANSFERASE
Ref.: CRYSTAL STRUCTURES OF AN ATP-DEPENDENT HEXOKINASE WITH BROAD SUBSTRATE SPECIFICITY FROM THE HYPERTHERMOPHILIC ARCHAEON SULFOLOBUS TOKODAII. J.BIOL.CHEM. V. 282 9923 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:600;
B:601;
Valid;
Valid;
none;
none;
Ki = 18 uM
427.201 C10 H15 N5 O10 P2 c1nc(...
EPE B:605;
Invalid;
none;
submit data
238.305 C8 H18 N2 O4 S C1CN(...
SO4 A:603;
B:602;
B:604;
Invalid;
Invalid;
Invalid;
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
2E2P 2 Å EC: 2.7.1.1 CRYSTAL STRUCTURE OF SULFOLOBUS TOKODAII HEXOKINASE IN COMPLEX WITH ADP SULFOLOBUS TOKODAII ACETATE AND SUGAR KINASES/HSP70/ACTIN SUPERFAMILY RIBONUCLEASE-H FOLD SUGAR KINASE GLUCOSE N- ACETYLGLUCOSAMINEHEXOKINASE CONFORMATIONAL CHANGE PHOSPHORYL TRANSFER TRANSFERASE
Ref.: CRYSTAL STRUCTURES OF AN ATP-DEPENDENT HEXOKINASE WITH BROAD SUBSTRATE SPECIFICITY FROM THE HYPERTHERMOPHILIC ARCHAEON SULFOLOBUS TOKODAII. J.BIOL.CHEM. V. 282 9923 2007
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 2E2O - BGC C6 H12 O6 C([C@@H]1[....
2 2E2P Ki = 18 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 2E2Q - XYP C5 H10 O5 C1[C@H]([C....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 2E2O - BGC C6 H12 O6 C([C@@H]1[....
2 2E2P Ki = 18 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 2E2Q - XYP C5 H10 O5 C1[C@H]([C....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2E2O - BGC C6 H12 O6 C([C@@H]1[....
2 2E2P Ki = 18 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 2E2Q - XYP C5 H10 O5 C1[C@H]([C....
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
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2E2P; Ligand: ADP; Similar sites found with APoc: 145
This union binding pocket(no: 1) in the query (biounit: 2e2p.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
1 6BKL RIM None
2 3WXL ADP 1.67224
3 3VET CP 1.67224
4 3VET TOY 1.67224
5 3VET ADP 1.67224
6 5BWD FUM 1.67224
7 1SAZ ACP 2.00669
8 2YCH ATP 2.00669
9 4XFR CIT 2.34114
10 4WZ8 3W7 2.34114
11 4WOP CTP 2.66667
12 3LM9 ADP 2.67559
13 3LM9 FRU 2.67559
14 1TUK PGM 2.98507
15 6B3V 7DQ 3.01003
16 6B3V ANP 3.01003
17 4GNI ATP 3.01003
18 5OBY ANP 3.01003
19 3QFU ADP 3.01003
20 4CZG ADP 3.01003
21 4CZG QH3 3.01003
22 2V7Y ADP 3.01003
23 5OBU ANP 3.01003
24 5AR0 GB8 3.34448
25 6G3R ADP 3.34448
26 5FPE 3TR 3.34448
27 3LDQ 3P1 3.34448
28 5FPN KYD 3.34448
29 4DHY GLC 3.67893
30 5EXW 7DT 3.67893
31 3WQT ANP 3.67893
32 2BUP ATP 3.67893
33 2BUP ADP 3.67893
34 4D7E FAD 3.67893
35 4JNE ATP 3.67893
36 4ZLU 4PW 3.67893
37 6ASY ATP 3.67893
38 4YDU ADP 3.67893
39 1MO9 FAD 3.67893
40 2UYT LRH 3.67893
41 2UYT ADP 3.67893
42 4ZLU ADP 3.67893
43 6EOF ADP 3.67893
44 1E8G FAD 3.67893
45 1E8G FCR 3.67893
46 2ZFZ ARG 3.79747
47 1SBR VIB 4
48 3AAQ ARU 4.01338
49 4A2B AGS 4.01338
50 4BR5 ANP 4.01338
51 1TUU ADP 4.34783
52 1TUU AMP 4.34783
53 1TUU PIS 4.34783
54 4O08 PO6 4.34783
55 2IVN ANP 4.34783
56 4XH4 ANP 4.34783
57 4XH4 PPI 4.34783
58 1T9D FAD 4.34783
59 5OSW DIU 4.68227
60 5O22 C3R 4.84429
61 1YRO UDP 4.87805
62 5HV7 RBL 5.35117
63 5V4R MGT 5.55556
64 1YAG ATP 5.6
65 5TUF TDC 5.62347
66 5TUF FAD 5.62347
67 3RYC GTP 5.68562
68 4WQ2 3SU 5.78035
69 4A59 AMP 6.02007
70 1XPJ TLA 6.34921
71 5U7W ADE 6.35452
72 5HTX ADP 6.35452
73 5EOU ATP 6.68896
74 5ECP ATP 6.68896
75 5ECP JAA 6.68896
76 5ECP MET 6.68896
77 4BGB ADP 7.02341
78 2W41 ADP 7.35786
79 2QXL ATP 7.35786
80 3TTC ADP 7.35786
81 3T31 FAD 7.69231
82 3T31 DCQ 7.69231
83 5IM3 DTP 7.69231
84 5WHU SIA 8.05369
85 1Q7B NAP 8.19672
86 2QWO ADP 8.69565
87 1Q9I TEO 8.69565
88 1Q9I FAD 8.69565
89 2D0O ADP 8.8
90 5EYP GDP 8.87574
91 1QO8 FAD 9.0301
92 4O4Z N2O 9.09091
93 3SJH LAR 9.699
94 4B1V LAB 9.699
95 4B1V ATP 9.699
96 2FXU ATP 9.699
97 5YEE ATP 9.699
98 4H03 LAR 9.699
99 4H03 ATP 9.699
100 2V51 ATP 9.699
101 4B1W ATP 9.699
102 2Q97 ATP 9.699
103 1SQK ADP 9.699
104 3U9Z ADP 9.699
105 5M67 3D1 9.699
106 5M67 NAD 9.699
107 4Z94 ATP 9.699
108 4PKI ATP 9.699
109 4PKG ATP 9.699
110 2PAV ATP 9.699
111 5ZZB ATP 9.699
112 2FF6 ATP 9.699
113 2A42 ATP 9.699
114 3SJH ATP 9.699
115 2FF3 ATP 9.699
116 2D1K ATP 9.699
117 4B1X ATP 9.699
118 2A40 ATP 9.699
119 3MN5 ATP 9.699
120 1KXP ATP 10.0334
121 2BTO GTP 10.1852
122 5LJW ANP 10.3679
123 3CIP ATP 10.7023
124 4EFH ADP 10.7023
125 3GUZ PAF 10.7955
126 4PL8 ATP 10.9589
127 4CBX ATP 11.3712
128 1RJ9 GCP 11.3712
129 4CBU ATP 11.7057
130 4URF 1PS 12.5
131 5G3U ITW 12.709
132 3MN7 ATP 13.0435
133 3MN6 ATP 13.0435
134 3U4L ATP 13.0435
135 3MN9 ATP 13.0435
136 5LY3 ADP 14.3813
137 3VGL ANP 16.388
138 3KIF GDL 16.9811
139 4EHU ANP 18.1159
140 5ZZA ATP 19.0083
141 2PBD ATP 20.9302
142 1XXA ARG 25.641
143 5YPU ATP 31.8182
144 2A3Z ATP 34.4828
145 4A2A ATP 43.75
Pocket No.: 2; Query (leader) PDB : 2E2P; Ligand: ADP; Similar sites found with APoc: 82
This union binding pocket(no: 2) in the query (biounit: 2e2p.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
1 6BKL EU7 None
2 3IPQ 965 1.06007
3 1RJD SAM 1.67224
4 1NHX FTB 2.00669
5 1NHX PEP 2.00669
6 3Q9T FAY 2.00669
7 1XRO LEU 2.04778
8 4WKI 3PW 2.12766
9 4B9Q ATP 2.34114
10 3CQD ATP 2.34114
11 2IHU TP9 2.34114
12 1I9Z 2IP 2.34114
13 1F74 NAY 2.73038
14 1XG5 NAP 2.86738
15 4BNU 9KQ 2.97398
16 4Q4K FMN 3.01003
17 1YS4 NAP 3.01003
18 5KZD RCJ 3.07167
19 1KDO C 3.0837
20 3KFC 61X 3.16206
21 3ZKK XYP XYP XYP XYP 3.34448
22 2IID FAD 3.34448
23 2IID PHE 3.34448
24 2HQM FAD 3.34448
25 5NMX FAD 3.34448
26 3CV9 VDX 3.34448
27 4IN9 SER TRP PHE PRO 3.61446
28 2GV8 FAD 3.67893
29 4G2R H1L 3.67893
30 2BD0 NAP 3.68852
31 5DXV NAP 3.84615
32 4AUT FAD 4.01338
33 1QMG DMV 4.01338
34 2YG3 FAD 4.01338
35 2C78 PUL 4.01338
36 1DJN ADP 4.01338
37 2WET FAD 4.01338
38 1I00 D16 4.13793
39 1I00 UMP 4.13793
40 2XVF FAD 4.34783
41 2DXU BT5 4.68085
42 5TS5 FAD 4.68227
43 2Z3Y F2N 4.68227
44 3NRR D16 4.68227
45 3NRR UMP 4.68227
46 6CS8 F9Y 4.68227
47 2J1P GRG 4.77816
48 5EVY FAD 4.79452
49 1L3I SAH 5.20833
50 1JXZ BCA 5.57621
51 4CTA ATP 5.68562
52 4RPL FAD 6.02007
53 4RPL 3UC 6.02007
54 4EIL NDP 6.02007
55 3OTI C0T 6.35452
56 1W6U NAP 6.35452
57 4MP8 NAD 6.68896
58 4MP8 MLI 6.68896
59 4IXH Q21 6.68896
60 1NVM NAD 6.68896
61 3IA4 NDP 6.79012
62 5EYK 5U5 6.88406
63 1GPE FAD 7.02341
64 6A0S HSE 7.69231
65 6A0S NDP 7.69231
66 4V1T ADP 7.69231
67 4IV9 FAD 8.3612
68 4J56 FAD 8.77193
69 2ZGY GDP 9.0301
70 1COY FAD 9.36455
71 4CJX 9L9 9.699
72 5G3U FDA 12.709
73 4PL7 ATP 12.709
74 3GGO NAI 14.0468
75 5H3A D16 14.841
76 1O94 ADP 15.7191
77 1ATL 0QI 15.8416
78 1ZUI SKM 17.8571
79 5JIC ADP 20.1465
80 5JIC N7E 20.1465
81 3ZCB ATP 25.8065
82 5NWD 9C8 26.5306
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