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Receptor
PDB id Resolution Class Description Source Keywords
3CQD 1.98 Å EC: 2.7.1.11 STRUCTURE OF THE TETRAMERIC INHIBITED FORM OF PHOSPHOFRUCTOK FROM ESCHERICHIA COLI ESCHERICHIA COLI PHOSPHOFRUCTOKINASES PFK-2 ESCHERICHIA COLI GLYCOLYSIS TRANSFERASE
Ref.: CRYSTALLOGRAPHIC STRUCTURE OF PHOSPHOFRUCTOKINASE-2 ESCHERICHIA COLI IN COMPLEX WITH TWO ATP MOLECULES. IMPLICATIONS FOR SUBSTRATE INHIBITION. J.MOL.BIOL. V. 383 588 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP A:313;
B:312;
A:314;
B:311;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MG A:311;
A:312;
A:310;
B:310;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3CQD 1.98 Å EC: 2.7.1.11 STRUCTURE OF THE TETRAMERIC INHIBITED FORM OF PHOSPHOFRUCTOK FROM ESCHERICHIA COLI ESCHERICHIA COLI PHOSPHOFRUCTOKINASES PFK-2 ESCHERICHIA COLI GLYCOLYSIS TRANSFERASE
Ref.: CRYSTALLOGRAPHIC STRUCTURE OF PHOSPHOFRUCTOKINASE-2 ESCHERICHIA COLI IN COMPLEX WITH TWO ATP MOLECULES. IMPLICATIONS FOR SUBSTRATE INHIBITION. J.MOL.BIOL. V. 383 588 2008
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3N1C - F6P C6 H13 O9 P C([C@@H]1[....
2 3CQD - 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 2 families.
1 3N1C - F6P C6 H13 O9 P C([C@@H]1[....
2 3CQD - 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 2 families.
1 3N1C - F6P C6 H13 O9 P C([C@@H]1[....
2 3CQD - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ATP; Similar ligands found: 422
No: Ligand ECFP6 Tc MDL keys Tc
1 HEJ 1 1
2 ATP 1 1
3 5FA 0.985507 1
4 AQP 0.985507 1
5 AP5 0.927536 0.971831
6 B4P 0.927536 0.971831
7 BA3 0.913043 0.971831
8 ADP 0.9 1
9 A2D 0.884058 0.971831
10 AGS 0.84 0.945946
11 SAP 0.84 0.945946
12 6YZ 0.833333 0.972222
13 AT4 0.810811 0.958904
14 AN2 0.810811 0.985915
15 25L 0.809524 0.985915
16 AR6 0.802632 0.971831
17 APR 0.802632 0.971831
18 M33 0.8 0.958333
19 ACQ 0.794872 0.972222
20 TAT 0.794872 0.958904
21 T99 0.794872 0.958904
22 AD9 0.792208 0.972222
23 ACP 0.789474 0.972222
24 AMP 0.788732 0.971429
25 A 0.788732 0.971429
26 ANP 0.772152 0.972222
27 CA0 0.753247 0.945205
28 ADX 0.753247 0.873418
29 A22 0.746988 0.985915
30 50T 0.74359 0.958333
31 PRX 0.734177 0.893333
32 APC 0.734177 0.958904
33 ABM 0.733333 0.917808
34 ATF 0.731707 0.958904
35 ITT 0.730769 0.943662
36 7D4 0.730769 0.905405
37 ADQ 0.729412 0.945205
38 A3R 0.729412 0.907895
39 AP2 0.714286 0.958904
40 A12 0.714286 0.958904
41 A1R 0.709302 0.907895
42 SRA 0.706667 0.918919
43 5AL 0.698795 0.931507
44 HFD 0.695122 0.945946
45 9X8 0.693182 0.92
46 OAD 0.693182 0.945205
47 AU1 0.6875 0.972222
48 SRP 0.682353 0.906667
49 G5P 0.680851 0.921053
50 25A 0.678161 0.971831
51 3OD 0.677778 0.945205
52 4AD 0.670455 0.92
53 G3A 0.670213 0.921053
54 00A 0.662921 0.883117
55 RBY 0.662651 0.932432
56 ADP PO3 0.662651 0.943662
57 ADV 0.662651 0.932432
58 BIS 0.659341 0.933333
59 8QN 0.659091 0.931507
60 5SV 0.659091 0.848101
61 OOB 0.659091 0.931507
62 GTA 0.65625 0.886076
63 UP5 0.653061 0.92
64 AMO 0.651685 0.932432
65 PAJ 0.651685 0.884615
66 2A5 0.650602 0.918919
67 MAP 0.647727 0.945946
68 3AT 0.647059 0.971831
69 AHX 0.644444 0.896104
70 DLL 0.644444 0.931507
71 ATR 0.642857 0.971429
72 PAP 0.642857 0.985714
73 PTJ 0.641304 0.896104
74 7D3 0.6375 0.905405
75 3UK 0.637363 0.918919
76 SON 0.634146 0.932432
77 A4P 0.633663 0.843373
78 ALF ADP 0.632184 0.87013
79 ADP ALF 0.632184 0.87013
80 PR8 0.630435 0.85
81 WAQ 0.630435 0.883117
82 LAD 0.630435 0.860759
83 B5V 0.630435 0.906667
84 AFH 0.628866 0.884615
85 LMS 0.628205 0.82716
86 GAP 0.627907 0.893333
87 DTP 0.627907 0.905405
88 VO4 ADP 0.625 0.931507
89 ADP VO4 0.625 0.931507
90 TXA 0.623656 0.932432
91 ME8 0.623656 0.839506
92 1ZZ 0.623656 0.839506
93 NB8 0.623656 0.896104
94 FYA 0.623656 0.905405
95 DQV 0.622449 0.958333
96 T5A 0.621359 0.841463
97 ADN 0.619718 0.84507
98 RAB 0.619718 0.84507
99 XYA 0.619718 0.84507
100 DAL AMP 0.611111 0.905405
101 9SN 0.610526 0.871795
102 48N 0.61 0.896104
103 AP0 0.607843 0.896104
104 9ZD 0.604396 0.907895
105 9ZA 0.604396 0.907895
106 FA5 0.604167 0.906667
107 B5M 0.604167 0.894737
108 YAP 0.604167 0.894737
109 B5Y 0.604167 0.894737
110 NAI 0.60396 0.907895
111 6V0 0.60396 0.896104
112 TXD 0.60396 0.907895
113 DND 0.60396 0.932432
114 NXX 0.60396 0.932432
115 NAX 0.60396 0.873418
116 ADP BMA 0.602151 0.918919
117 A2R 0.6 0.985915
118 OMR 0.598039 0.851852
119 TXE 0.598039 0.907895
120 XAH 0.597938 0.839506
121 7DT 0.593023 0.985714
122 AOC 0.592593 0.821918
123 4UV 0.591837 0.894737
124 DDS 0.590909 0.878378
125 139 0.590476 0.873418
126 CNA 0.584906 0.932432
127 6AD 0.58427 0.909091
128 5AS 0.583333 0.77907
129 5N5 0.581081 0.819444
130 GA7 0.58 0.906667
131 4UU 0.58 0.894737
132 4TC 0.576923 0.896104
133 ADJ 0.575472 0.851852
134 5CD 0.573333 0.805556
135 A4D 0.573333 0.819444
136 RGT 0.571429 0.958904
137 A3P 0.571429 0.971429
138 7D5 0.56962 0.878378
139 LAQ 0.568627 0.839506
140 F2R 0.564815 0.864198
141 80F 0.563636 0.841463
142 YLP 0.563107 0.819277
143 A A 0.5625 0.944444
144 UPA 0.561905 0.907895
145 AV2 0.56044 0.917808
146 COD 0.559633 0.811765
147 4UW 0.557692 0.860759
148 JB6 0.556701 0.883117
149 3AM 0.555556 0.929577
150 ATP A A A 0.555556 0.930556
151 A2P 0.552941 0.957143
152 TYM 0.552381 0.906667
153 NA7 0.552083 0.958904
154 EP4 0.551282 0.753247
155 MYR AMP 0.55102 0.817073
156 PPS 0.549451 0.873418
157 YLC 0.54717 0.839506
158 YLB 0.54717 0.819277
159 NAD 0.545455 0.931507
160 DAT 0.545455 0.905405
161 TYR AMP 0.544554 0.87013
162 G5A 0.544444 0.77907
163 M2T 0.544304 0.734177
164 DTA 0.544304 0.786667
165 3DH 0.54321 0.773333
166 128 0.542857 0.776471
167 AHZ 0.538462 0.817073
168 GTP 0.537634 0.92
169 SSA 0.537634 0.8
170 MTA 0.5375 0.773333
171 IOT 0.537037 0.831325
172 A3D 0.535714 0.918919
173 ARG AMP 0.533981 0.829268
174 7MD 0.533981 0.8625
175 AR6 AR6 0.533981 0.917808
176 YLA 0.53211 0.819277
177 AMP DBH 0.529412 0.893333
178 IMO 0.529412 0.929577
179 TAD 0.528846 0.884615
180 AYB 0.527273 0.809524
181 A5A 0.526882 0.807229
182 HDV 0.526882 0.893333
183 TSB 0.526316 0.819277
184 EAD 0.525424 0.873418
185 2AM 0.52439 0.943662
186 6RE 0.52381 0.759494
187 7DD 0.522727 0.985714
188 V3L 0.521739 0.971831
189 AVV 0.520833 0.896104
190 BTX 0.517857 0.841463
191 NAE 0.517241 0.894737
192 52H 0.515789 0.77907
193 54H 0.515789 0.788235
194 VMS 0.515789 0.788235
195 NSS 0.515464 0.8
196 BT5 0.513274 0.831325
197 NAQ 0.512821 0.871795
198 ZAS 0.511905 0.766234
199 J7C 0.511628 0.769231
200 A3N 0.511628 0.786667
201 5X8 0.511111 0.763158
202 53H 0.510417 0.77907
203 8X1 0.510417 0.752809
204 5CA 0.510417 0.8
205 NVA LMS 0.510204 0.752809
206 ARU 0.510204 0.860759
207 AF3 ADP 3PG 0.509259 0.8375
208 ZID 0.508475 0.918919
209 P1H 0.508197 0.851852
210 OVE 0.505882 0.905405
211 S4M 0.505747 0.666667
212 LEU LMS 0.50505 0.752809
213 LPA AMP 0.504673 0.817073
214 7MC 0.504587 0.841463
215 DZD 0.5 0.884615
216 FB0 0.5 0.804598
217 MAO 0.5 0.759036
218 DSZ 0.5 0.8
219 LSS 0.5 0.761364
220 DSH 0.5 0.725
221 P5A 0.5 0.744444
222 NDE 0.495935 0.932432
223 N0B 0.495798 0.819277
224 M24 0.495726 0.85
225 YLY 0.495726 0.809524
226 NJP 0.495575 0.945946
227 9K8 0.49505 0.714286
228 MGP 0.494737 0.884615
229 6C6 0.494624 0.881579
230 NAJ PZO 0.491379 0.848101
231 0WD 0.491228 0.921053
232 6G0 0.489583 0.884615
233 GJV 0.488636 0.75
234 6FA 0.488189 0.841463
235 5AD 0.486842 0.746479
236 KAA 0.485149 0.752809
237 GSU 0.485149 0.77907
238 71V 0.483146 0.907895
239 NEC 0.482759 0.746667
240 A3G 0.482759 0.8
241 ODP 0.482456 0.909091
242 FAS 0.48062 0.851852
243 FAD 0.48062 0.851852
244 7D7 0.480519 0.743243
245 FDA 0.480315 0.833333
246 N6P 0.48 0.915493
247 2SA 0.479167 0.932432
248 GP3 0.478723 0.921053
249 4TA 0.478261 0.807229
250 SFG 0.478261 0.75
251 G A A A 0.478261 0.871795
252 AMP NAD 0.478261 0.905405
253 NPW 0.477876 0.886076
254 NDP 0.477876 0.921053
255 NDC 0.47619 0.871795
256 YSA 0.47619 0.77907
257 NAJ PYZ 0.475 0.807229
258 MGO 0.474227 0.860759
259 GDP 0.473684 0.92
260 NZQ 0.473684 0.909091
261 TXP 0.473684 0.921053
262 6IA 0.473684 0.8375
263 A7D 0.472527 0.776316
264 SFD 0.469231 0.734043
265 A5D 0.468085 0.786667
266 SA8 0.468085 0.707317
267 ZDA 0.468085 0.864865
268 12D 0.46789 0.785714
269 PGS 0.467391 0.883117
270 MHZ 0.467391 0.697674
271 8PZ 0.466667 0.8
272 62F 0.466165 0.8625
273 DA 0.465909 0.878378
274 D5M 0.465909 0.878378
275 GGZ 0.464646 0.825
276 SAH 0.463158 0.74359
277 SAI 0.463158 0.734177
278 FAY 0.462687 0.8625
279 Y3J 0.4625 0.726027
280 PO4 PO4 A A A A PO4 0.460784 0.902778
281 AAM 0.460674 0.971429
282 RFL 0.459259 0.821429
283 SMM 0.459184 0.686047
284 HF7 0.459184 0.893333
285 AMZ 0.458824 0.916667
286 C2R 0.458824 0.90411
287 SAM 0.458333 0.690476
288 A3S 0.456522 0.810811
289 FNK 0.455224 0.804598
290 U A 0.453782 0.907895
291 7C5 0.453704 0.818182
292 EEM 0.453608 0.690476
293 AAT 0.453608 0.707317
294 XNP 0.452991 0.873418
295 A G 0.452991 0.883117
296 PRT 0.45283 0.931507
297 AIR 0.451219 0.901408
298 62X 0.45098 0.666667
299 DCA 0.45 0.823529
300 ETB 0.45 0.833333
301 GSP 0.45 0.873418
302 U A G G 0.449153 0.883117
303 NIA 0.448276 0.822785
304 A3T 0.446809 0.821918
305 A A A 0.446602 0.905405
306 K15 0.446602 0.682353
307 PUA 0.446281 0.884615
308 6K6 0.445545 0.930556
309 GEK 0.445545 0.7375
310 4YB 0.445455 0.761364
311 S7M 0.444444 0.690476
312 Z5A 0.443548 0.77907
313 1DG 0.443548 0.921053
314 DG1 0.443548 0.921053
315 0T1 0.442623 0.823529
316 COA 0.442623 0.823529
317 WSA 0.442478 0.788235
318 8BR 0.43956 0.906667
319 8Q2 0.438596 0.772727
320 101 0.438202 0.878378
321 IDP 0.4375 0.918919
322 NVA 2AD 0.4375 0.759494
323 9JJ 0.435714 0.8625
324 NAP 0.435484 0.945205
325 APU 0.434783 0.894737
326 A U 0.434783 0.87013
327 7RP 0.433333 0.928571
328 A6D 0.432692 0.722892
329 AMX 0.432 0.833333
330 J7V 0.432 0.833333
331 TAP 0.432 0.907895
332 COS 0.432 0.804598
333 CAO 0.432 0.795455
334 30N 0.432 0.752688
335 V1N 0.431193 0.917808
336 649 0.429825 0.744444
337 P5F 0.429577 0.823529
338 NA0 0.428571 0.932432
339 SCO 0.428571 0.823529
340 CMX 0.428571 0.823529
341 7RA 0.428571 0.957747
342 0UM 0.427184 0.698795
343 GAV 0.427184 0.884615
344 QQY 0.426966 0.815789
345 1RB 0.426966 0.885714
346 ACK 0.426966 0.861111
347 G1R 0.425743 0.907895
348 GCP 0.425743 0.896104
349 FAM 0.425197 0.804598
350 FCX 0.425197 0.795455
351 ACO 0.425197 0.795455
352 GNH 0.424242 0.907895
353 F2N 0.423611 0.813953
354 GKE 0.422018 0.884615
355 GDD 0.422018 0.884615
356 GDC 0.422018 0.884615
357 HAX 0.421875 0.804598
358 3AD 0.421687 0.805556
359 9GM 0.421569 0.896104
360 GNP 0.421569 0.896104
361 FA9 0.42069 0.864198
362 TM1 0.420561 0.77381
363 KB1 0.420561 0.698795
364 H6Y 0.42 0.945205
365 2MC 0.419847 0.769231
366 3KK 0.418605 0.804598
367 FYN 0.418605 0.823529
368 S8M 0.417476 0.759494
369 7L1 0.417323 0.795455
370 2VA 0.416667 0.8
371 26A 0.416667 0.763158
372 NHD 0.416667 0.905405
373 QQX 0.41573 0.805195
374 CA6 0.415385 0.729167
375 OXK 0.415385 0.804598
376 COK 0.415385 0.804598
377 SOP 0.415385 0.804598
378 MCD 0.415385 0.804598
379 YE1 0.413534 0.813953
380 RMB 0.413043 0.873239
381 FAI 0.413043 0.916667
382 AS 0.413043 0.833333
383 CO6 0.412214 0.804598
384 1VU 0.412214 0.795455
385 CMC 0.412214 0.804598
386 NMX 0.412214 0.76087
387 SXZ 0.411215 0.710843
388 ANZ 0.410714 0.8
389 SCA 0.410448 0.804598
390 CAJ 0.409091 0.804598
391 SCD 0.409091 0.823529
392 EO7 0.408602 0.788235
393 D3Y 0.407767 0.789474
394 CC5 0.407407 0.816901
395 KH3 0.40708 0.674419
396 A C A C 0.406504 0.848101
397 SLU 0.406504 0.770115
398 G 0.40625 0.906667
399 5GP 0.40625 0.906667
400 A1S 0.406015 0.804598
401 IVC 0.406015 0.813953
402 MLC 0.406015 0.804598
403 3HC 0.406015 0.813953
404 1HE 0.406015 0.786517
405 BCO 0.406015 0.804598
406 GTG 0.405405 0.886076
407 NMN AMP PO4 0.404959 0.87013
408 3D1 0.404762 0.773333
409 3L1 0.404762 0.773333
410 2BA 0.404255 0.915493
411 CMP 0.404255 0.901408
412 VRT 0.40404 0.769231
413 SO8 0.40404 0.789474
414 MCA 0.402985 0.795455
415 COO 0.402985 0.804598
416 CAA 0.402985 0.813953
417 3NZ 0.401869 0.782051
418 G2R 0.401869 0.884615
419 ZZB 0.4 0.77381
420 2FA 0.4 0.813333
421 MC4 0.4 0.76087
422 2CP 0.4 0.795455
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3CQD; Ligand: ATP; Similar sites found with APoc: 148
This union binding pocket(no: 1) in the query (biounit: 3cqd.bio1) has 52 residues
No: Leader PDB Ligand Sequence Similarity
1 4WG0 CHD None
2 5YSQ INS 1.3986
3 1RQH PYR 1.61812
4 3LRE ADP 1.61812
5 4A59 AMP 1.94175
6 2G50 PYR 1.94175
7 2VVG ADP 1.94175
8 2YPI PGA 2.02429
9 1BG2 ADP 2.26537
10 5YV5 ADP 2.26537
11 1YQT ADP 2.26537
12 2C49 ANP 2.31788
13 2C49 ADN 2.31788
14 2E2P ADP 2.34114
15 5EPA AKG 2.50896
16 2D6M LBT 2.51572
17 4TR9 38D 2.589
18 5L2R MLA 2.589
19 4PVR ASP 2.589
20 5H6S HDH 2.589
21 2GMP NAG MAN 2.77778
22 1OJ4 ANP 2.82686
23 3BJE URA 2.91262
24 5O5Y GLC 2.91262
25 3HQP OXL 2.91262
26 5E4R 40E 2.91262
27 4XDZ 40E 2.91262
28 2KIN ADP 2.94118
29 1IS3 LAT 2.96296
30 5OD2 GLC 3.23625
31 5OD2 5ID 3.23625
32 1T9D P22 3.23625
33 2J5V PCA 3.23625
34 4Y24 TD2 3.24675
35 3AQT RCO 3.26531
36 2I6A 5I5 3.55987
37 4O48 ASP 3.55987
38 1GOJ ADP 3.55987
39 4L80 OXL 3.55987
40 4KCT PYR 3.55987
41 4IP7 FLC 3.55987
42 4YJI TYL 3.55987
43 1SLT NDG GAL 3.73134
44 3VV1 GAL FUC 3.75
45 3RZ3 U94 3.82514
46 5ZI9 FLC 3.84615
47 2VWT PYR 4.11985
48 4Q86 AMP 4.20712
49 3B6C SDN 4.2735
50 3WV6 GAL BGC 4.39189
51 3WV6 GAL GLC 4.39189
52 4FHT DHB 4.4586
53 2Y65 ADP 4.53074
54 2YMZ LAT 4.61538
55 2F6U CIT 4.70085
56 1G0H IPD 4.7619
57 5TCI MLI 4.85437
58 3ZJX BOG 4.85437
59 1O9P MLA 4.85437
60 3AI3 SOL 4.94297
61 2WQ4 SFU 5.12821
62 1XZ3 ICF 5.17241
63 4CP8 MLI 5.17799
64 5W3Y ACO 5.17799
65 2P7Q GG6 5.26316
66 1P0Z FLC 5.34351
67 3M3E GAL A2G NPO 5.59006
68 3QDV NDG 5.59441
69 5C9J DAO 5.69395
70 5O0J 8BR 5.82524
71 5O0J GLC 5.82524
72 3DRW AMP 5.82524
73 2FN1 PYR 5.82524
74 3COB ADP 5.82524
75 4K7O EKZ 5.95238
76 3ZS7 ATP 6
77 1C9K 5GP 6.11111
78 2Y7P SAL 6.42202
79 4GYS MLI 6.44122
80 1YBH P22 6.47249
81 3WUD GLC GAL 6.61765
82 1VBO MAN MAN MAN 6.71141
83 1APZ ASP 6.79012
84 5YJS SAL 6.79612
85 2FR6 CTN 6.84932
86 1A8U BEZ 6.85921
87 4L9Z OXL 7.11974
88 5E9G GLV 7.11974
89 2CBZ ATP 7.173
90 1C3Q TZE 7.39437
91 1S8G DAO 7.43802
92 5WS9 OXL 7.44337
93 1JI0 ATP 7.5
94 2CZL TLA 7.72059
95 4RYV ZEA 7.74194
96 3NIP 16D 7.76699
97 4Z87 GDP 7.76699
98 3PA8 621 7.87402
99 2HYQ MAN MAN 8.19672
100 4PVV HO4 8.41424
101 3HRD NIO 8.41424
102 2QPU QPU 8.41424
103 2QPU QPS 8.41424
104 1FNZ A2G 8.43882
105 5W7B MYR 8.51064
106 6FA4 D1W 8.67052
107 1A78 TDG 8.95522
108 5IXB LGA 9.25926
109 3B1Q NOS 9.5092
110 3NV3 GAL NAG MAN 10.1449
111 5CLO NS8 10.1695
112 4XF6 INS 10.2564
113 4XF6 LIP 10.2564
114 4XF6 ADP 10.2564
115 1UA4 GLC 10.6796
116 1UA4 BGC 10.6796
117 1UA4 AMP 10.6796
118 1Z42 FMN 10.6796
119 1XPJ TLA 11.1111
120 1TL2 NDG 11.8644
121 3WUC GLC GAL 12.4088
122 5DG2 GAL GLC 12.5926
123 3OTX AP5 12.6214
124 1T0S BML 13.2686
125 3NC9 TR3 13.2686
126 2HW1 FRU 13.7584
127 2HW1 ANP 13.7584
128 1YP4 ADP 13.9159
129 2ABS ACP 14.8825
130 4C5N ACP 15.2174
131 4C5N PXL 15.2174
132 4XDA ADP 16.8285
133 4XDA RIB 16.8285
134 2VAR ANP 17.1521
135 2VAR AMP 17.1521
136 1B4U DHB 17.9856
137 3LOO B4P 18.123
138 1IZC PYR 18.123
139 1V1A ADP 19.0939
140 1V1A KDG 19.0939
141 6FOF LAT 19.898
142 1RKD RIB 22.0065
143 1RKD ADP 22.0065
144 4OGQ 7PH 23.5294
145 5C2N NAG 31.25
146 2JG1 TA6 42.7184
147 2JG1 ANP 42.7184
148 2JGV ADP 43.6893
Pocket No.: 2; Query (leader) PDB : 3CQD; 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: 2) in the query (biounit: 3cqd.bio1) has 52 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3CQD; Ligand: ATP; Similar sites found with APoc: 22
This union binding pocket(no: 3) in the query (biounit: 3cqd.bio1) has 42 residues
No: Leader PDB Ligand Sequence Similarity
1 4ZNO SUC 1.94175
2 5OLR RAM ADA RAM 1.94175
3 5EO8 TFU 2.26537
4 3AIH BMA MAN MAN 2.41935
5 2GMM MAN MAN 2.77778
6 4D4U FUC GAL NAG 2.91262
7 1FHW I5P 3.10078
8 4AMF ACP 3.23625
9 1O5Q PYR 3.27869
10 1GUI BGC BGC BGC BGC BGC BGC 3.87097
11 5BRP PNG 3.8835
12 3ZXE PGZ 4.51128
13 6F7X MFU 5.55556
14 4H69 10Y 6.18557
15 4CSD MFU 6.61765
16 5TQZ GLC 8
17 2NU5 NAG 8.19672
18 2NUO BGC 8.19672
19 2GUC MAN 8.19672
20 2GUD MAN 8.19672
21 2HYR BGC GLC 8.19672
22 2BS5 BGC GAL FUC 20
Pocket No.: 4; Query (leader) PDB : 3CQD; 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: 3cqd.bio1) has 42 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3CQD; Ligand: ATP; Similar sites found with APoc: 26
This union binding pocket(no: 5) in the query (biounit: 3cqd.bio1) has 26 residues
No: Leader PDB Ligand Sequence Similarity
1 5YGE GLU None
2 5CB3 APR 1.0929
3 3PF7 MLA 1.2945
4 1DNP FAD 1.2945
5 2D3M COA 1.61812
6 4XSU UDP 1.61812
7 3P5P A3C 1.94175
8 1JBW ACQ 1.94175
9 4NE2 SH2 2.26537
10 4NE2 ADP 2.26537
11 3B1F NAD 2.41379
12 5NII FAD 2.589
13 3ZEI AWH 2.589
14 3LPF Z77 2.589
15 3FW4 CAQ 2.80899
16 4ORR PE3 3.15789
17 6C6O ENG 3.23625
18 3GGO NAI 3.23625
19 1KOR SIN 4.53074
20 4W6Z 8ID 4.85437
21 2F1K NAP 5.37634
22 3FV1 DYH 5.46875
23 5K7H IVC 5.62771
24 4D86 ADP 6.79612
25 1GTE FAD 7.44337
26 3LVW GSH 19.4175
Pocket No.: 6; Query (leader) PDB : 3CQD; 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: 3cqd.bio1) has 26 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3CQD; Ligand: ATP; Similar sites found with APoc: 33
This union binding pocket(no: 7) in the query (biounit: 3cqd.bio1) has 54 residues
No: Leader PDB Ligand Sequence Similarity
1 1VMK GUN 1.80505
2 1RYD GLC 1.94175
3 4OKS 2T9 1.94175
4 3UDG TMP 1.99336
5 2ZV2 609 2.01342
6 3ICS ADP 2.26537
7 4XFR CIT 2.589
8 5U97 PIT 2.91262
9 5EOO CIT 3.01887
10 3K5I AIR 3.23625
11 5WKC TP9 3.23625
12 4WBD CIT 3.55987
13 1H3F TYE 3.55987
14 2W5P CL8 4.02685
15 3QPB URA 4.20712
16 2X2M X2M 4.53074
17 2F5X ASP 4.85437
18 6HKE MLT 5.17799
19 6HKE LMR 5.17799
20 4MRP GSH 5.17799
21 2XOM GAL GAL GAL 5.26316
22 2QES ADE 5.36398
23 3NKV GNP 6.28571
24 4EN4 GT1 7.11974
25 4EN4 ATP 7.11974
26 4EN4 GT0 7.11974
27 1HBK MYR 7.86517
28 4UP5 94W 10.101
29 1LYX PGA 11.6935
30 5E5U MLI 12.5
31 2VAR KDG 17.1521
32 2VAR KDF 17.1521
33 4NAE 1GP 22.6667
Pocket No.: 8; Query (leader) PDB : 3CQD; 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: 8) in the query (biounit: 3cqd.bio1) has 54 residues
No: Leader PDB Ligand Sequence Similarity
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