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Receptor
PDB id Resolution Class Description Source Keywords
3TIF 1.8 Å NON-ENZYME: TRANSPORT DIMERIC STRUCTURE OF A POST-HYDROLYSIS STATE OF THE ATP-BIND CASSETTE MJ0796 BOUND TO ADP AND PI METHANOCALDOCOCCUS JANNASCHII DSM 2661ORGANISM_TAXID: 243232 NUCLEOTIDE-BINDING DOMAIN ABC TRANSPORTER ATPASE ATP BINDIBINDING PROTEIN
Ref.: KINETICS OF THE ASSOCIATION/DISSOCIATION CYCLE OF A ATP-BINDING CASSETTE NUCLEOTIDE-BINDING DOMAIN. J.BIOL.CHEM. V. 287 4157 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:236;
B:1;
Valid;
Valid;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
IPA A:1600;
A:1602;
B:1601;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
60.095 C3 H8 O CC(C)...
NA A:238;
B:1237;
Part of Protein;
Part of Protein;
none;
none;
submit data
22.99 Na [Na+]
PI A:237;
B:1236;
Invalid;
Invalid;
none;
none;
submit data
95.979 H O4 P OP(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1L2T 1.9 Å NON-ENZYME: TRANSPORT DIMERIC STRUCTURE OF MJ0796, A BACTERIAL ABC TRANSPORTER CASSETTE METHANOCALDOCOCCUS JANNASCHII ABC TRANSPORTERS ATPASE WALKER-A NBD TRANSPORT PROTEIN
Ref.: ATP BINDING TO THE MOTOR DOMAIN FROM AN ABC TRANSPORTER DRIVES FORMATION OF A NUCLEOTIDE SANDWICH DIMER. MOL.CELL V. 10 139 2002
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 209 families.
1 3TIF - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
2 1L2T Kd ~ 800 uM ATP C10 H16 N5 O13 P3 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 175 families.
1 3TIF - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
2 1L2T Kd ~ 800 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 149 families.
1 1B0U - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3TIF - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP; Similar ligands found: 452
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 HEJ 0.9 1
3 ATP 0.9 1
4 A2D 0.895522 0.971831
5 5FA 0.887324 1
6 AQP 0.887324 1
7 AP5 0.884058 0.971831
8 B4P 0.884058 0.971831
9 BA3 0.869565 0.971831
10 AN2 0.84507 0.985915
11 AT4 0.84507 0.958904
12 M33 0.833333 0.958333
13 ACQ 0.826667 0.972222
14 A 0.823529 0.971429
15 AMP 0.823529 0.971429
16 ACP 0.821918 0.972222
17 6YZ 0.818182 0.972222
18 APR 0.810811 0.971831
19 AR6 0.810811 0.971831
20 ANP 0.802632 0.972222
21 SAP 0.8 0.945946
22 AGS 0.8 0.945946
23 AD9 0.8 0.972222
24 ADX 0.783784 0.873418
25 CA0 0.783784 0.945205
26 TAT 0.779221 0.958904
27 T99 0.779221 0.958904
28 50T 0.773333 0.958333
29 ABM 0.763889 0.917808
30 APC 0.763158 0.958904
31 PRX 0.763158 0.893333
32 ATF 0.759494 0.958904
33 A22 0.753086 0.985915
34 AP2 0.743243 0.958904
35 A12 0.743243 0.958904
36 SRA 0.736111 0.918919
37 ADQ 0.73494 0.945205
38 25L 0.732558 0.985915
39 5AL 0.725 0.931507
40 2A5 0.717949 0.918919
41 A1R 0.714286 0.907895
42 AU1 0.714286 0.972222
43 A3R 0.714286 0.907895
44 ATR 0.708861 0.971429
45 ADP PO3 0.708861 0.943662
46 PAP 0.708861 0.985714
47 SRP 0.707317 0.906667
48 7D3 0.706667 0.905405
49 25A 0.702381 0.971831
50 9X8 0.697674 0.92
51 OAD 0.697674 0.945205
52 RBY 0.6875 0.932432
53 ADV 0.6875 0.932432
54 00A 0.686047 0.883117
55 OOB 0.682353 0.931507
56 5SV 0.682353 0.848101
57 8QN 0.682353 0.931507
58 3OD 0.681818 0.945205
59 BIS 0.681818 0.933333
60 ALF ADP 0.674699 0.87013
61 ADP ALF 0.674699 0.87013
62 AMO 0.674419 0.932432
63 4AD 0.674419 0.92
64 PAJ 0.674419 0.884615
65 GAP 0.670732 0.893333
66 MAP 0.670588 0.945946
67 AHX 0.666667 0.896104
68 VO4 ADP 0.666667 0.931507
69 DLL 0.666667 0.931507
70 ADP VO4 0.666667 0.931507
71 PTJ 0.662921 0.896104
72 3UK 0.659091 0.918919
73 SON 0.658228 0.932432
74 LMS 0.653333 0.82716
75 LAD 0.651685 0.860759
76 WAQ 0.651685 0.883117
77 B5V 0.651685 0.906667
78 PR8 0.651685 0.85
79 ITT 0.65 0.943662
80 7D4 0.65 0.905405
81 G5P 0.648936 0.921053
82 XYA 0.647059 0.84507
83 ADN 0.647059 0.84507
84 RAB 0.647059 0.84507
85 1ZZ 0.644444 0.839506
86 ME8 0.644444 0.839506
87 FYA 0.644444 0.905405
88 NB8 0.644444 0.896104
89 TXA 0.644444 0.932432
90 6AD 0.642857 0.909091
91 ADP BMA 0.640449 0.918919
92 G3A 0.638298 0.921053
93 DAL AMP 0.632184 0.905405
94 AFH 0.631579 0.884615
95 9SN 0.630435 0.871795
96 9ZA 0.625 0.907895
97 DQV 0.625 0.958333
98 9ZD 0.625 0.907895
99 GTA 0.625 0.886076
100 YAP 0.623656 0.894737
101 B5M 0.623656 0.894737
102 FA5 0.623656 0.906667
103 B5Y 0.623656 0.894737
104 UP5 0.622449 0.92
105 HFD 0.619048 0.945946
106 XAH 0.617021 0.839506
107 AV2 0.616279 0.917808
108 AOC 0.615385 0.821918
109 48N 0.612245 0.896104
110 4UV 0.610526 0.894737
111 6V0 0.606061 0.896104
112 NAI 0.606061 0.907895
113 DND 0.606061 0.932432
114 NAX 0.606061 0.873418
115 NXX 0.606061 0.932432
116 TXD 0.606061 0.907895
117 5N5 0.605634 0.819444
118 5AS 0.604938 0.77907
119 A4P 0.60396 0.843373
120 DAT 0.60241 0.905405
121 A2R 0.602273 0.985915
122 TXE 0.6 0.907895
123 OMR 0.6 0.851852
124 4UU 0.597938 0.894737
125 GA7 0.597938 0.906667
126 A A 0.597826 0.944444
127 A4D 0.597222 0.819444
128 5CD 0.597222 0.805556
129 AP0 0.594059 0.896104
130 4TC 0.594059 0.896104
131 A3P 0.592593 0.971429
132 T5A 0.592233 0.841463
133 139 0.592233 0.873418
134 7D5 0.592105 0.878378
135 ATP A A A 0.589474 0.930556
136 LAQ 0.585859 0.839506
137 MYR AMP 0.585106 0.817073
138 F2R 0.580952 0.864198
139 YLP 0.58 0.819277
140 UPA 0.578431 0.907895
141 7DD 0.578313 0.985714
142 3AM 0.576923 0.929577
143 ADJ 0.576923 0.851852
144 COD 0.575472 0.811765
145 NAD 0.575472 0.931507
146 3AT 0.574713 0.971831
147 JB6 0.574468 0.883117
148 4UW 0.574257 0.860759
149 EP4 0.573333 0.753247
150 A2P 0.573171 0.957143
151 CNA 0.571429 0.932432
152 TYM 0.568627 0.906667
153 PPS 0.568182 0.873418
154 DTA 0.565789 0.786667
155 M2T 0.565789 0.734177
156 AR6 AR6 0.565657 0.917808
157 A3D 0.564815 0.918919
158 80F 0.564815 0.841463
159 3DH 0.564103 0.773333
160 G5A 0.563218 0.77907
161 YLB 0.563107 0.819277
162 YLC 0.563107 0.839506
163 AMP DBH 0.561224 0.893333
164 TYR AMP 0.561224 0.87013
165 MTA 0.558442 0.773333
166 DTP 0.556818 0.905405
167 AHZ 0.554455 0.817073
168 NA7 0.553191 0.958904
169 IOT 0.552381 0.831325
170 ZAS 0.55 0.766234
171 7MD 0.55 0.8625
172 ARG AMP 0.55 0.829268
173 IMO 0.548781 0.929577
174 YLA 0.54717 0.819277
175 NAE 0.544643 0.894737
176 TAD 0.544554 0.884615
177 A5A 0.544444 0.807229
178 2AM 0.544304 0.943662
179 TSB 0.543478 0.819277
180 6RE 0.54321 0.759494
181 AYB 0.542056 0.809524
182 NAQ 0.539823 0.871795
183 V3L 0.539326 0.971831
184 SSA 0.538462 0.8
185 AF3 ADP 3PG 0.538462 0.8375
186 ZID 0.535088 0.918919
187 LPA AMP 0.533981 0.817073
188 52H 0.532609 0.77907
189 VMS 0.532609 0.788235
190 54H 0.532609 0.788235
191 BTX 0.53211 0.841463
192 A3N 0.53012 0.786667
193 J7C 0.53012 0.769231
194 5X8 0.528736 0.763158
195 BT5 0.527273 0.831325
196 8X1 0.526882 0.752809
197 5CA 0.526882 0.8
198 53H 0.526882 0.77907
199 ARU 0.526316 0.860759
200 EAD 0.525862 0.873418
201 RGT 0.525253 0.958904
202 OVE 0.52439 0.905405
203 S4M 0.52381 0.666667
204 7DT 0.522727 0.985714
205 GDP 0.522222 0.92
206 DDS 0.522222 0.878378
207 AVV 0.521277 0.896104
208 NDE 0.521008 0.932432
209 7MC 0.518868 0.841463
210 DSH 0.518072 0.725
211 MAO 0.517647 0.759036
212 NSS 0.515789 0.8
213 DSZ 0.515789 0.8
214 LSS 0.515789 0.761364
215 P5A 0.515464 0.744444
216 DZD 0.513514 0.884615
217 NVA LMS 0.510417 0.752809
218 9K8 0.510204 0.714286
219 12D 0.509615 0.785714
220 M24 0.508772 0.85
221 YLY 0.508772 0.809524
222 P1H 0.508333 0.851852
223 5AD 0.506849 0.746479
224 GJV 0.505882 0.75
225 LEU LMS 0.505155 0.752809
226 AMP NAD 0.504505 0.905405
227 4TA 0.504505 0.807229
228 G A A A 0.504505 0.871795
229 NAJ PZO 0.504425 0.848101
230 GSU 0.5 0.77907
231 128 0.5 0.776471
232 KAA 0.5 0.752809
233 71V 0.5 0.907895
234 A3G 0.5 0.8
235 NDC 0.5 0.871795
236 7D7 0.5 0.743243
237 N0B 0.495726 0.819277
238 NJP 0.495495 0.945946
239 ODP 0.495495 0.909091
240 2SA 0.494624 0.932432
241 6C6 0.494505 0.881579
242 SFG 0.494382 0.75
243 0WD 0.491071 0.921053
244 YSA 0.490196 0.77907
245 PO4 PO4 A A A A PO4 0.489796 0.902778
246 SAM 0.48913 0.690476
247 6IA 0.48913 0.8375
248 A7D 0.488636 0.776316
249 6FA 0.488 0.841463
250 FB0 0.487805 0.804598
251 NAJ PYZ 0.487179 0.807229
252 A5D 0.483516 0.786667
253 IDP 0.483516 0.918919
254 SA8 0.483516 0.707317
255 PGS 0.483146 0.883117
256 MHZ 0.483146 0.697674
257 DA 0.482353 0.878378
258 D5M 0.482353 0.878378
259 NEC 0.482353 0.746667
260 NIA 0.481928 0.822785
261 Y3J 0.480519 0.726027
262 8PZ 0.480392 0.8
263 FAD 0.480315 0.851852
264 FAS 0.480315 0.851852
265 FDA 0.48 0.833333
266 N6P 0.479592 0.915493
267 GGZ 0.479167 0.825
268 U A 0.478261 0.907895
269 SAH 0.478261 0.74359
270 SAI 0.478261 0.734177
271 A G 0.477876 0.883117
272 NPW 0.477477 0.886076
273 NDP 0.477477 0.921053
274 AAM 0.476744 0.971429
275 C2R 0.47561 0.90411
276 AMZ 0.47561 0.916667
277 A A A 0.474747 0.905405
278 GTP 0.473684 0.92
279 U A G G 0.473684 0.883117
280 SMM 0.473684 0.686047
281 NZQ 0.473214 0.909091
282 TXP 0.473214 0.921053
283 A3S 0.47191 0.810811
284 SFD 0.46875 0.734043
285 AIR 0.468354 0.901408
286 AAT 0.468085 0.707317
287 EEM 0.468085 0.690476
288 J7V 0.466667 0.833333
289 Z5A 0.466667 0.77907
290 7C5 0.466667 0.818182
291 62F 0.465649 0.8625
292 HDV 0.463158 0.893333
293 FAY 0.462121 0.8625
294 A3T 0.461538 0.821918
295 ETB 0.461538 0.833333
296 DCA 0.461538 0.823529
297 A6D 0.46 0.722892
298 A U 0.459459 0.87013
299 GEK 0.459184 0.7375
300 6K6 0.459184 0.930556
301 RFL 0.458647 0.821429
302 NAP 0.458333 0.945205
303 S7M 0.458333 0.690476
304 4YB 0.457944 0.761364
305 WSA 0.454545 0.788235
306 TAP 0.454545 0.907895
307 FNK 0.454545 0.804598
308 COA 0.453782 0.823529
309 0T1 0.453782 0.823529
310 101 0.453488 0.878378
311 XNP 0.452174 0.873418
312 NA0 0.45082 0.932432
313 7RP 0.448276 0.928571
314 GP3 0.446809 0.921053
315 TM1 0.446602 0.77381
316 APU 0.446429 0.894737
317 PUA 0.445378 0.884615
318 V1N 0.443396 0.917808
319 7RA 0.443182 0.957747
320 COS 0.442623 0.804598
321 AMX 0.442623 0.833333
322 30N 0.442623 0.752688
323 CAO 0.442623 0.795455
324 QQY 0.44186 0.815789
325 ACK 0.44186 0.861111
326 649 0.441441 0.744444
327 0UM 0.44 0.698795
328 NHD 0.439655 0.905405
329 CMX 0.439024 0.823529
330 SCO 0.439024 0.823529
331 GCP 0.438776 0.896104
332 8BR 0.438202 0.906667
333 GNH 0.4375 0.907895
334 8Q2 0.4375 0.772727
335 3AD 0.4375 0.805556
336 NVA 2AD 0.43617 0.759494
337 62X 0.435644 0.666667
338 FCX 0.435484 0.795455
339 ACO 0.435484 0.795455
340 FAM 0.435484 0.804598
341 9JJ 0.434783 0.8625
342 GNP 0.434343 0.896104
343 9GM 0.434343 0.896104
344 NMX 0.433071 0.76087
345 MGP 0.43299 0.884615
346 26A 0.432099 0.763158
347 HAX 0.432 0.804598
348 K15 0.431373 0.682353
349 DG1 0.430894 0.921053
350 1DG 0.430894 0.921053
351 QQX 0.430233 0.805195
352 2VA 0.430108 0.8
353 S8M 0.43 0.759494
354 2MC 0.429688 0.769231
355 6G0 0.428571 0.884615
356 P5F 0.428571 0.823529
357 FYN 0.428571 0.823529
358 3KK 0.428571 0.804598
359 A C A C 0.428571 0.848101
360 7L1 0.427419 0.795455
361 FAI 0.426966 0.916667
362 RMB 0.426966 0.873239
363 AS 0.426966 0.833333
364 1RB 0.425287 0.885714
365 CA6 0.425197 0.729167
366 SOP 0.425197 0.804598
367 OXK 0.425197 0.804598
368 MCD 0.425197 0.804598
369 COK 0.425197 0.804598
370 G1R 0.424242 0.907895
371 SXZ 0.423077 0.710843
372 CC5 0.423077 0.816901
373 F2N 0.422535 0.813953
374 EO7 0.422222 0.788235
375 ANZ 0.422018 0.8
376 1VU 0.421875 0.795455
377 CMC 0.421875 0.804598
378 CO6 0.421875 0.804598
379 ZDA 0.421053 0.864865
380 GKE 0.420561 0.884615
381 GDC 0.420561 0.884615
382 GDD 0.420561 0.884615
383 NFD 0.420168 0.883117
384 GSP 0.42 0.873418
385 D3Y 0.42 0.789474
386 MC4 0.419847 0.76087
387 3D1 0.419753 0.773333
388 3L1 0.419753 0.773333
389 FA9 0.41958 0.864198
390 5GP 0.419355 0.906667
391 G 0.419355 0.906667
392 KB1 0.419048 0.698795
393 CAJ 0.418605 0.804598
394 SCD 0.418605 0.823529
395 CMP 0.417582 0.901408
396 2BA 0.417582 0.915493
397 SO8 0.416667 0.789474
398 VRT 0.416667 0.769231
399 N01 0.416667 0.905405
400 IVC 0.415385 0.813953
401 1HE 0.415385 0.786517
402 A1S 0.415385 0.804598
403 BCO 0.415385 0.804598
404 3HC 0.415385 0.813953
405 MLC 0.415385 0.804598
406 NMN AMP PO4 0.415254 0.87013
407 2FA 0.414634 0.813333
408 MGO 0.414141 0.860759
409 3NZ 0.413462 0.782051
410 COO 0.412214 0.804598
411 MCA 0.412214 0.795455
412 YE1 0.412214 0.813953
413 CAA 0.412214 0.813953
414 GAV 0.411765 0.884615
415 PRT 0.411215 0.931507
416 JLN 0.411111 0.890411
417 P2P 0.411111 0.902778
418 ZZB 0.410256 0.77381
419 SP1 0.409091 0.842105
420 RP1 0.409091 0.842105
421 2CP 0.409091 0.795455
422 SCA 0.409091 0.804598
423 103 0.409091 0.837838
424 PAX 0.408 0.829268
425 FAD NBT 0.407143 0.75
426 COW 0.406015 0.795455
427 3CP 0.406015 0.804598
428 IRC 0.406015 0.813953
429 BYC 0.406015 0.804598
430 CA8 0.406015 0.729167
431 1GZ 0.406015 0.795455
432 COF 0.406015 0.786517
433 HGG 0.406015 0.804598
434 2KQ 0.406015 0.786517
435 G2P 0.405941 0.884615
436 SLU 0.404959 0.770115
437 U A C C 0.404959 0.858974
438 RBZ 0.404494 0.849315
439 1CZ 0.404412 0.795455
440 FAQ 0.402985 0.804598
441 BCA 0.402985 0.795455
442 4CA 0.402985 0.795455
443 MTP 0.402439 0.730769
444 8OD 0.402062 0.945205
445 CO7 0.401515 0.804598
446 GRA 0.4 0.804598
447 G2R 0.4 0.884615
448 ENQ 0.4 0.916667
449 CNV FAD 0.4 0.8
450 GMV 0.4 0.896104
451 HXC 0.4 0.786517
452 HF7 0.4 0.893333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: 643
This union binding pocket(no: 1) in the query (biounit: 1l2t.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 5KUT GDP None
2 3Q85 GNP None
3 2NLQ GLY None
4 4WOP CTP None
5 3QXC ATP 1.2766
6 3N9R TD3 1.70213
7 2QEN ADP 1.70213
8 5WDR GNP 1.75439
9 2VOH CIT 1.91083
10 3H86 AP5 2.08333
11 1NJF ADP 2.12766
12 1NJF AGS 2.12766
13 3DC4 ADP 2.12766
14 2XTZ GSP 2.12766
15 1ZCB GDP 2.12766
16 1NN5 2DT 2.32558
17 1NN5 ANP 2.32558
18 4BAS GNP 2.51256
19 2VVG ADP 2.55319
20 2PL3 ADP 2.55319
21 4R43 GDP 2.55319
22 2I6U CP 2.55319
23 3KC1 2T6 2.55319
24 2WPF FAD 2.55319
25 2WPF WPF 2.55319
26 5LV1 78T 2.55319
27 4NSQ COA 2.63158
28 4KFU ACP 2.83019
29 2W58 ADP 2.9703
30 1CM0 COA 2.97619
31 2Y65 ADP 2.97872
32 2FAH GDP 2.97872
33 3RC3 ANP 2.97872
34 5IRR GSP 2.97872
35 2BIF SIN 2.97872
36 2BIF ANP 2.97872
37 3IO3 ADP 2.97872
38 2J5V PCA 2.97872
39 4GR5 APC 2.97872
40 1K6M AGS 2.97872
41 1LDN FBP 2.97872
42 2WGV CIT 2.97872
43 2DVZ GLU 2.97872
44 1CLU DBG 3.01205
45 2F9L GDP 3.01508
46 3IUY AMP 3.07018
47 3SBD GNP 3.20856
48 4DKX GDP 3.24074
49 4TTQ ATP 3.25581
50 2J0V GDP 3.30189
51 2Y8E GNP 3.35196
52 1BG2 ADP 3.40426
53 4LC1 GDP 3.40426
54 6A4R ASP 3.40426
55 1RRC ADP 3.40426
56 4YS0 ADP 3.40426
57 1ZC3 GNP 3.42857
58 1UAD GNP 3.42857
59 3GFS FMN 3.44828
60 1SNN 5RP 3.52423
61 2F5X ASP 3.52564
62 1U8Z GDP 3.57143
63 5G41 AP5 3.58744
64 1O8B ABF 3.65297
65 4NU0 AP5 3.68664
66 4MKF AP5 3.68664
67 1ZIN AP5 3.68664
68 3KIF GDL 3.77358
69 3RWO GDP 3.78378
70 2XT3 ADP 3.82979
71 3DKP ADP 3.82979
72 1ION ADP 3.82979
73 6C90 ADP 3.82979
74 6AU6 GDP 3.82979
75 3Q9L ATP 3.82979
76 2B8W ALF 5GP 3.82979
77 2NCD ADP 3.82979
78 1P72 ADP 3.82979
79 1OFH ADP 3.82979
80 6H5E ANP 3.82979
81 4PJ3 ANP 3.82979
82 1G41 ADP 3.82979
83 2HXW FLC 3.82979
84 4RZ3 ADP 3.82979
85 1F5N GNP 3.82979
86 5UI2 SUC 3.82979
87 2ZE7 DST 3.82979
88 5M04 GDP 3.82979
89 5TVM PUT 3.82979
90 3VX3 ADP 3.82979
91 2HK1 FUD 3.82979
92 2OZE AGS 3.82979
93 5WS9 ATP 3.82979
94 1O9P MLA 3.82979
95 3BER AMP 3.82979
96 1PUJ GNP 3.82979
97 2RGX AP5 3.8835
98 3B7G ANP 3.91304
99 5G3Y ADP 3.9823
100 2HF9 GSP 3.9823
101 2W2X GSP 4.03226
102 1Z83 AP5 4.08163
103 1AKY AP5 4.09091
104 2FFQ GSP 4.09357
105 4MKG AP5 4.14747
106 1I4D GDP 4.16667
107 3FB4 AP5 4.16667
108 3MJH GTP 4.16667
109 3ZFD ANP 4.25532
110 4J0Q GDP 4.25532
111 6G14 G4P 4.25532
112 1W5T ANP 4.25532
113 3ITJ CIT 4.25532
114 5K5Z ANP 4.25532
115 1QHG ATP 4.25532
116 3FKQ ATP 4.25532
117 4TL6 ANP 4.25532
118 3H4S ADP 4.25532
119 1W5T ADP 4.25532
120 4FRZ ADP 4.25532
121 4NCN GTP 4.25532
122 1Q19 SSC 4.25532
123 4TMZ GSP 4.25532
124 5H4S RAM 4.25532
125 3FWY ADP 4.25532
126 3MD0 GDP 4.25532
127 1KGZ PRP 4.25532
128 5HCN GCP 4.25532
129 4ZKD GDP 4.25532
130 3QDK QDK 4.25532
131 1R6B ADP 4.25532
132 2QZ4 ADP 4.25532
133 3WGT FAD 4.25532
134 4Y4V DAL 4.25532
135 3F5A SIA GAL NAG 4.25532
136 3AQ4 GDP 4.34783
137 5UIV ADP 4.40529
138 1UKZ ADP 4.4335
139 1DS6 GDP 4.44444
140 1DAK DPU 4.46429
141 1DAK ADP 4.46429
142 5E5U MLI 4.52261
143 3GJ4 GDP 4.52489
144 3GJ0 GDP 4.52489
145 5J1J ANP 4.5614
146 2C5L GTP 4.62428
147 5BXQ GDP 4.62963
148 1IBR GNP 4.62963
149 5FTB ANP 4.68085
150 1SQ5 ADP 4.68085
151 3E70 GDP 4.68085
152 5FHD ADP ALF 4.68085
153 3DZD ADP 4.68085
154 2WKQ GTP 4.68085
155 5VGR GDP 4.68085
156 4NE2 SH2 4.68085
157 4NE2 ADP 4.68085
158 3VMF GTP 4.68085
159 1F9V ADP 4.68085
160 2C9O ADP 4.68085
161 2P3V SRT 4.68085
162 1VKJ A3P 4.68085
163 1T5C ADP 4.68085
164 1GPE FAD 4.68085
165 1XX6 ADP 4.71204
166 4KVG GTP 4.7619
167 2ZTS ADP 4.78088
168 4HDQ GNP 4.79042
169 4HDO GNP 4.79042
170 3X1Z GNP 4.79042
171 2UZI GTP 4.81928
172 1Y63 ADP 4.8913
173 1D5C GDP 4.93827
174 1X1R GDP 5.05618
175 1S3G AP5 5.06912
176 3BC1 GNP 5.08475
177 1GOJ ADP 5.10638
178 4AG5 ADP 5.10638
179 1YRB GDP 5.10638
180 2ZR9 DTP 5.10638
181 5YT0 GDP 5.10638
182 4B47 GDP 5.10638
183 2CE7 ADP 5.10638
184 5W76 GDP 5.10638
185 4IHQ ADP 5.10638
186 4DCT GDP 5.10638
187 2VB6 ADP BEF 5.10638
188 1SVK ALF GDP 5.10638
189 1BH2 GSP 5.10638
190 1CS4 GSP 5.10638
191 2XAU ADP 5.10638
192 4PFO ADP 5.10638
193 1E2K TMC 5.10638
194 2BEK ATP 5.10638
195 4WEI GLC GAL 5.10638
196 1IHU AF3 5.10638
197 2X7I CIT 5.10638
198 1OYY AGS 5.10638
199 1IHU ADP 5.10638
200 2RCN GDP 5.10638
201 1Y3A GDP 5.10638
202 2OM2 GDP 5.10638
203 3L6C MLI 5.10638
204 3CNL GNP 5.10638
205 1NY5 ADP 5.10638
206 2ORV 4TA 5.12821
207 4R2I ANP 5.2381
208 3RAB GNP 5.32544
209 3DEF GDP 5.34351
210 1ZUI SKM 5.35714
211 1GWN GTP 5.36585
212 1RYH GNP 5.41872
213 3CX8 GSP 5.41872
214 3GJ8 GDP 5.43478
215 2EW1 GNP 5.47264
216 5XKT GNP 5.5
217 3T5G GDP 5.52486
218 6A20 ADP 5.53191
219 1V8K ANP 5.53191
220 3EWA ANP 5.53191
221 3TK1 GDP 5.53191
222 3U6B GDP 5.53191
223 5ZBR ANP 5.53191
224 1D8T GDP 5.53191
225 3U6K GDP 5.53191
226 1WDT GTP 5.53191
227 5H7J GCP 5.53191
228 4YJ1 ADP 5.53191
229 5I0H ADP BEF 5.53191
230 1G3Q ADP 5.53191
231 2BVN GNP 5.53191
232 1WF3 GNP 5.53191
233 3FYH ADP 5.53191
234 2GDJ ANP 5.53191
235 1CR1 TTP 5.53191
236 2Q2Y ADP 5.53191
237 2Q2Y MKR 5.53191
238 2C78 GNP 5.53191
239 2C77 GNP 5.53191
240 1XF1 CIT 5.53191
241 1G7S GDP 5.53191
242 5JBQ GDP 5.53191
243 4G5G GDP 5.53191
244 3IIJ ADP 5.55556
245 6BSX E7S 5.61798
246 6BSX GDP 5.61798
247 1G8S MET 5.65217
248 5XC5 GTP 5.68182
249 4BQS ADP 5.68182
250 4BQS K2Q 5.68182
251 4D0G GTP 5.71429
252 1KO8 6PG 5.71429
253 2YOH WMJ 5.71429
254 2OFW ADX 5.76923
255 1MH1 GNP 5.91398
256 2FH5 GTP 5.94595
257 5CK5 GDP 5.95745
258 2DPY ADP 5.95745
259 5IFS ADP 5.95745
260 2OBM ADP 5.95745
261 1YTM ATP 5.95745
262 6B4K ANP 5.95745
263 1IN4 ADP 5.95745
264 3HU3 AGS 5.95745
265 5EXT ADP 5.95745
266 3P4X ADP 5.95745
267 4HSE ADP 5.95745
268 4QOS ADP 5.95745
269 5M7P ADP 5.95745
270 1VHT BA3 5.9633
271 2QQ0 ANP 5.97826
272 2QQ0 TMP 5.97826
273 2QQ0 ADP 5.97826
274 1M7B GTP 5.97826
275 2QQ0 THM 5.97826
276 1G4U GDP 5.97826
277 5GVR LMR 5.98291
278 3TMK T5A 6.01852
279 3Q72 GNP 6.0241
280 2QG6 NMN 6.03015
281 5ZB0 TYD 6.06061
282 5ZB0 ADP 6.06061
283 1MR3 G3D 6.07735
284 1W4R TTP 6.15385
285 1M7G AV2 6.16114
286 1M7G ADX 6.16114
287 1M7G ADP 6.16114
288 1GUA GNP 6.17284
289 2FJU GSP 6.17978
290 1QF9 C5P 6.18557
291 1QF9 ALF 6.18557
292 1QF9 ADP 6.18557
293 1HE1 GDP 6.25
294 1HE1 AF3 6.25
295 1XPJ TLA 6.34921
296 5LB3 ADP 6.38298
297 3EC1 GDP 6.38298
298 4PC3 GDP 6.38298
299 2GKS ADP 6.38298
300 3GJX GTP 6.38298
301 3KJI ADP 6.38298
302 4HE2 AMP 6.38298
303 1G7C 5GP 6.38298
304 2J0W ASP 6.38298
305 2HV8 GTP 6.39535
306 1E96 GTP 6.40394
307 5OEC GDP 6.55738
308 1LVG ADP 6.56566
309 2D7C GTP 6.58683
310 3PQC GDP 6.66667
311 2PEZ DAT 6.70391
312 2PEZ GGZ 6.70391
313 3AB4 THR 6.74157
314 2DTJ THR 6.74157
315 1JJV ATP 6.79612
316 4LPS GDP 6.80851
317 4PX9 ADP 6.80851
318 5H7K GDP 6.80851
319 1FP6 ADP 6.80851
320 3ZQ6 ADP ALF 6.80851
321 4XGU ADP 6.80851
322 2GAG FOA 6.80851
323 2Q8M AMP 6.80851
324 4QDI ATP 6.80851
325 1W7J ADP BEF 6.80851
326 4WZA ACP 6.80851
327 4WZA ADP 6.80851
328 4Z7X 3CX 6.80851
329 5L3V GDP 6.80851
330 2OWZ CIT 6.80851
331 5BQ5 ADP BEF 6.87831
332 3UIE ANP 7
333 2ZEJ GDP 7.06522
334 1KMQ GNP 7.06522
335 1KY3 GDP 7.14286
336 4XOI GTP 7.22222
337 3A4M ADP 7.23404
338 5U32 GDP 7.23404
339 5BN3 ADP 7.23404
340 5FG3 GDP 7.23404
341 4LYA ATP 7.23404
342 3TBK ANP 7.23404
343 1Z6T ADP 7.23404
344 3EZ2 ADP 7.23404
345 1TQ4 GDP 7.23404
346 5N69 ADP 7.23404
347 3WXM GTP 7.23404
348 1XP8 AGS 7.23404
349 4K81 GTP 7.23404
350 4OHY ANP 7.23404
351 1OS1 ATP 7.23404
352 2JK0 ASP 7.23404
353 1OS1 PYR 7.23404
354 4U5X GNP 7.30337
355 1TX4 ALF GDP 7.34463
356 1TKU 5RP 7.35294
357 5Z2M GTP 7.38636
358 5EE5 GTP 7.51174
359 2BME GNP 7.52688
360 2GJ8 ALF GDP 7.55814
361 2A9K GDP 7.62332
362 3WY9 GDP 7.65957
363 1KK1 GNP 7.65957
364 4FCW ADP 7.65957
365 4LJ9 ACP 7.65957
366 1SVM ATP 7.65957
367 3WYA GDP 7.65957
368 2IS6 ADP 7.65957
369 4P3Y GDP 7.69231
370 4E03 ADP 7.76699
371 4DID GDP 7.77202
372 5FII PHE 7.84314
373 1GRN GDP 7.8534
374 1A4R GDP 7.8534
375 1A4R GNH 7.8534
376 4ITR GDP 7.8534
377 5SZH GNP 7.88177
378 2WMO GTP 7.89474
379 5UQW GDP 7.93651
380 5OCG GNP 7.93651
381 2G77 AF3 8.08081
382 2G77 GDP 8.08081
383 1XMV ADP 8.08511
384 1U0J ADP 8.08511
385 4BFW ZVW 8.08511
386 4A4Z ANP 8.08511
387 5J1S ATP 8.08511
388 4LX0 BEF GDP 8.08511
389 2FNA ADP 8.08511
390 5JCZ GDP 8.08511
391 4H1V GNP 8.08511
392 3LRE ADP 8.08511
393 3QVP FAD 8.08511
394 5TB5 GDP 8.10811
395 5TAR GDP 8.10811
396 5UPK GNP 8.10811
397 2O66 FLC 8.14815
398 3GJ7 GDP 8.16327
399 3M1I GTP 8.21918
400 3WYF GTP 8.21918
401 4YC7 GNP 8.28729
402 1UPT GTP 8.33333
403 5UWP GNP 8.39161
404 5DIF GNP 8.39161
405 5UWS GNP 8.39161
406 5UWO GNP 8.39161
407 5UWW GNP 8.39161
408 5DHF GNP 8.39161
409 5UWH GNP 8.39161
410 6CIT GNP 8.39161
411 5UWI GNP 8.39161
412 5DI9 GNP 8.39161
413 4C4P GNP 8.41121
414 5KSP GDP 8.42105
415 5TSH ADP 8.51064
416 5TSH ANP 8.51064
417 1XKV ATP 8.51064
418 1MKY GDP 8.51064
419 1W0J ADP BEF 8.51064
420 2V7Q ADP 8.51064
421 2CK3 ADP 8.51064
422 2CK3 ANP 8.51064
423 1W0J ADP 8.51064
424 1LVK MNT BEF 8.51064
425 4M9Q GNP 8.51064
426 4DDY DN6 8.51064
427 4IDN GNP 8.51064
428 4RM0 FUC NAG GAL 8.51064
429 4URS C2E 8.51064
430 2V7Q ATP 8.51064
431 4HAT GNP 8.57143
432 3T1O GDP 8.58586
433 1NF3 GNP 8.59375
434 6FA4 GNP 8.67052
435 2B4B COA 8.77193
436 2B4D COA 8.77193
437 1FZQ GDP 8.83978
438 2EFE GNH 8.83978
439 2CJW GDP 8.85417
440 5O2T GSP 8.87574
441 2QN6 GDP 8.93617
442 3BFV ADP 8.93617
443 5W7Q GDP 8.93617
444 5WC2 ADP 8.93617
445 4RD0 GDP 8.93617
446 6CRK GDP 8.93617
447 1GP2 GDP 8.93617
448 4ZI2 GNP 8.94737
449 4GOJ GNP 8.99471
450 5WLB GNP 9.03614
451 4XZ3 ACP 9.13043
452 3NKV GNP 9.14286
453 2CHG ANP 9.29204
454 1G6O ADP 9.3617
455 1SKQ GDP 9.3617
456 4JLV ADP 9.3617
457 5L3W GDP 9.3617
458 5JCP GDP ALF 9.3617
459 1KAO GDP 9.3617
460 2JLR ANP 9.3617
461 3KUD GDP 9.3617
462 5L3S GNP 9.3617
463 5IRN ADP 9.3617
464 5NM7 GLY 9.3617
465 3BOS CDP 9.3617
466 4OI4 ATP 9.3617
467 5L3S G 9.3617
468 1LFD GNP 9.3617
469 3DDC GNP 9.3617
470 3DOO SKM 9.3617
471 1WQ1 GDP 9.3617
472 1IG0 VIB 9.3617
473 6DEF GCP 9.3617
474 4IOK ADP 9.3617
475 5E95 GDP 9.3617
476 5KSZ GCP 9.43396
477 1HTW ADP 9.49367
478 3E5H GNP 9.55056
479 3T12 GDP ALF 9.55882
480 2IL4 COA 9.70874
481 2HT6 GDP 9.77011
482 5VHC BEF ADP 9.78723
483 1UJ2 ADP 9.78723
484 1UJ2 C5P 9.78723
485 5GOE GDP 9.78723
486 6FAA ADP 9.78723
487 5Z69 AGS 9.78723
488 5ZHO A2G GLA FUC 9.87654
489 2GCO GNP 9.95025
490 2GCN GDP 9.95025
491 4V0K GDP 10.0592
492 1TU3 GNP 10.1266
493 2FSH ANP 10.2128
494 3TKL GTP 10.2128
495 4HI0 GDP 10.2128
496 1FQJ ALF 10.2128
497 1GOT GDP 10.2128
498 1FQK GDP 10.2128
499 1FQJ GDP 10.2128
500 5BSH PRO 10.2128
501 4JLS 3ZE 10.5263
502 5LEF GTP 10.6061
503 3ZS9 ADP ALF 10.6383
504 4XVU ATP 10.6383
505 4XTR ATP 10.6383
506 1TAD ALF 10.6383
507 1TAD GDP 10.6383
508 5AK0 8V1 10.6383
509 4XTR ADP 10.6383
510 2WOJ ADP ALF 10.6383
511 4D0N GDP 10.8108
512 3LXR GDP 10.8108
513 6BCB GSP 10.8108
514 6BCA GSP 10.8108
515 6BC0 GSP 10.8108
516 2CDN ADP 10.9453
517 1CXZ GSP 10.989
518 3SFV GDP 11.0497
519 5W75 SUC 11.0638
520 5W75 GDP 11.0638
521 4D81 ADP 11.0638
522 1H65 GDP 11.0638
523 5SXS NIZ 11.0638
524 1DNP MHF 11.0638
525 5O74 GDP 11.1111
526 1QHH ATP 11.2426
527 1KSH GDP 11.2903
528 2J59 GTP 11.3095
529 1LK7 DER 11.3537
530 1OW3 GDP 11.399
531 4YDS ATP 11.4035
532 4PPF FLC 11.4894
533 2OG2 MLI 11.4894
534 3B9Q MLI 11.4894
535 1DAR GDP 11.4894
536 3R7F CP 11.4894
537 1D2E GDP 11.4894
538 4LHW GNP 11.4943
539 3QBT GNP 11.4943
540 3TNF GNP 11.4943
541 3CPJ GDP 11.6592
542 5MVR ADP 11.7284
543 5IRC GDP 11.828
544 3REF GDP 11.8557
545 2VO4 4NM 11.8721
546 5DI3 GNP 11.8919
547 5HPY GDP 11.8919
548 5Y6N ADP 11.9149
549 2IYL GDP 11.9149
550 4KBF AMP 11.9149
551 1FNN ADP 11.9149
552 4ZG4 VO4 ADP 11.9149
553 1RJ9 GCP 11.9149
554 6ACS CIT 11.9149
555 5HR5 ADP 11.9149
556 2NGR GDP 11.9658
557 1B7T ADP 12.1795
558 5XDR ADP 12.3404
559 2D7D ADP 12.3404
560 6D59 GNP 12.3404
561 6D56 GNP 12.3404
562 6D5G GNP 12.3404
563 6D5J GNP 12.3404
564 6D5H GNP 12.3404
565 6BVL GNP 12.3404
566 6BVK GNP 12.3404
567 6BVJ GNP 12.3404
568 6D5E GNP 12.3404
569 6BVI GNP 12.3404
570 6D5V GNP 12.3404
571 1NVV GNP 12.3404
572 6BVM GNP 12.3404
573 6D5M GNP 12.3404
574 6D55 GNP 12.3404
575 6D5L GNP 12.3404
576 4X8O AP5 12.6168
577 3AB3 GDP 12.766
578 4KVA GTP 12.766
579 4P4T GDP 12.766
580 1SVI GDP 12.8205
581 1KK8 BEF ADP 12.9496
582 2WHX ADP 13.1915
583 5H68 AGS 13.1915
584 5MZN ADP 13.1915
585 2GK6 ADP 13.1915
586 2HCJ GDP 13.5135
587 3PCR GTP 13.5802
588 3QKT ANP 13.617
589 2A5F GTP 13.7143
590 2KIN ADP 14
591 4V03 ADP 14.0426
592 4LO2 GAL BGC 14.2857
593 3WYG GTP 14.4737
594 4XSH GSP 14.6119
595 3GJ5 GDP 14.7059
596 4KAX GTP 14.7929
597 3N5C GDP 14.8148
598 1BO4 COA 14.881
599 2QTV GNP 14.9701
600 3GJ3 GDP 15.1515
601 2W83 GTP 15.1515
602 4QRH 0O2 15.2381
603 3CH5 GDP 15.3846
604 2XTN GTP 15.3846
605 5LTJ BEF 15.7447
606 5LTJ ADP 15.7447
607 1X6V ADP 16.1702
608 4U8P UDP 16.1702
609 1EK0 GNP 16.4706
610 5H67 ATP 16.4894
611 4ZNL BEF ADP 17.0213
612 4YLG GDP 17.341
613 5KDO GDP 17.5676
614 4QM7 GTP 18.1287
615 3QF7 ANP 18.7234
616 4IEE AGS 19.1489
617 4Q1A 2XZ 19.5745
618 4Q1A UDP 19.5745
619 1G16 GDP 20
620 5L3R GCP 20
621 2X77 GDP 21.6931
622 3KTA AP5 21.9653
623 2ODE ALF GDP 21.9858
624 5UWR GNP 22.2222
625 1XEX ATP 23.8372
626 5UWU GNP 25
627 1GXU 2HP 25.2747
628 3DOE GTP 26.6667
629 5UWQ GNP 27.2727
630 4CVN ADP 28.2723
631 1F2U ATP 30.4054
632 2D2F ADP 32.766
633 5UWT GNP 34.7826
634 3ZIA ADP 34.9206
635 3ZIA ATP 34.9206
636 5ZXD ATP 40.8511
637 1R0X ATP 42.5532
638 5YV5 ADP 43.4043
639 1YQT ADP 43.8298
640 4WZ6 ATP 45.1064
641 6B8B ADP 46.383
642 2CBZ ATP 46.383
643 3FVQ ATP 49.7872
Pocket No.: 2; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: 25
This union binding pocket(no: 2) in the query (biounit: 1l2t.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
1 4NYT PC 1.84332
2 1NE7 AGP 2.55319
3 3FIU POP 2.97872
4 2F7A BEZ 3.44828
5 3UNN MET GLU ASP TPO GLN ALA ILE ASP 3.53982
6 2XZ9 PYR 3.82979
7 1K1Y MAL 4.68085
8 3CF6 SP1 4.79042
9 4JBL MET 5.10638
10 4CCN OGA 6.38298
11 4CCK OGA 6.38298
12 4Y3O OGA 6.38298
13 4CCO OGA 6.38298
14 2ZPA ADP 7.23404
15 4TR9 38D 7.65957
16 4BXF AKG 7.65957
17 1GRN AF3 7.8534
18 2GNK ATP 8.03571
19 1LOJ U 8.04598
20 4J6O CIT 8.08511
21 1H8P PC 9.17431
22 1WQ1 AF3 9.3617
23 5AYV KPL 10.2128
24 1WZ1 DNS 15.4472
25 4YRD 3IT 16.1702
Pocket No.: 3; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: 1
This union binding pocket(no: 3) in the query (biounit: 1l2t.bio2) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 4RF7 ARG 8.51064
Pocket No.: 4; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1l2t.bio2) has 24 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: 2
This union binding pocket(no: 5) in the query (biounit: 1l2t.bio2) has 25 residues
No: Leader PDB Ligand Sequence Similarity
1 4Z24 FAD 4.68085
2 5IM3 DTP 18.7234
Pocket No.: 6; Query (leader) PDB : 1L2T; Ligand: ATP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 1l2t.bio2) has 25 residues
No: Leader PDB Ligand Sequence Similarity
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