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Receptor
PDB id Resolution Class Description Source Keywords
4ZLU 1.8 Å EC: 2.7.-.- LIPOMYCES STARKEYI LEVOGLUCOSAN KINASE BOUND TO LEVOGLUCOSAN MAGNESIUM. LIPOMYCES STARKEYI SUGAR KINASE ATP-BINDING CARBOHYDRATE METABOLISM TRANSFER
Ref.: PRODUCING GLUCOSE 6-PHOSPHATE FROM CELLULOSIC BIOMA STRUCTURAL INSIGHTS INTO LEVOGLUCOSAN BIOCONVERSION J.BIOL.CHEM. V. 290 26638 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:604;
A:603;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
4PW B:503;
A:602;
Valid;
Valid;
none;
none;
submit data
162.141 C6 H10 O5 C1[C@...
ADP A:601;
B:501;
Valid;
Valid;
none;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
TRS B:502;
Invalid;
none;
submit data
122.143 C4 H12 N O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4ZLU 1.8 Å EC: 2.7.-.- LIPOMYCES STARKEYI LEVOGLUCOSAN KINASE BOUND TO LEVOGLUCOSAN MAGNESIUM. LIPOMYCES STARKEYI SUGAR KINASE ATP-BINDING CARBOHYDRATE METABOLISM TRANSFER
Ref.: PRODUCING GLUCOSE 6-PHOSPHATE FROM CELLULOSIC BIOMA STRUCTURAL INSIGHTS INTO LEVOGLUCOSAN BIOCONVERSION J.BIOL.CHEM. V. 290 26638 2015
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 4ZLU - 4PW C6 H10 O5 C1[C@@H]2[....
2 5TKR - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 4ZFV - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 5BVC - 4PW C6 H10 O5 C1[C@@H]2[....
5 4YH5 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 5BSB - 4PW C6 H10 O5 C1[C@@H]2[....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 4ZLU - 4PW C6 H10 O5 C1[C@@H]2[....
2 5TKR - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 4ZFV - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 5BVC - 4PW C6 H10 O5 C1[C@@H]2[....
5 4YH5 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 5BSB - 4PW C6 H10 O5 C1[C@@H]2[....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 4ZLU - 4PW C6 H10 O5 C1[C@@H]2[....
2 5TKR - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 4ZFV - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 5BVC - 4PW C6 H10 O5 C1[C@@H]2[....
5 4YH5 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 5BSB - 4PW C6 H10 O5 C1[C@@H]2[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 4PW; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 4PW 1 1
2 GLC GLC GLC GLC 0.5 0.777778
Ligand no: 2; 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 : 4ZLU; Ligand: ADP; Similar sites found with APoc: 159
This union binding pocket(no: 1) in the query (biounit: 4zlu.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
1 4GNC ASO 1.33779
2 3AKI AH8 1.34228
3 1COY FAD 1.34228
4 1COY AND 1.34228
5 4A62 ANP 1.5625
6 5HSA FAS 1.566
7 3VET TOY 1.78971
8 3VET ADP 1.78971
9 3VET CP 1.78971
10 2JB2 PHE 1.78971
11 2JB2 FAD 1.78971
12 3NTD FAD 1.78971
13 1AE1 NAP 1.8315
14 5LY3 ADP 1.85185
15 3MN9 ATP 1.87166
16 3MN6 ATP 1.87166
17 5T63 ALA ALA ALA ALA 1.90736
18 1DLL LAT 2.04082
19 5O22 C3R 2.07612
20 2ZGY GDP 2.1875
21 6B3V ANP 2.36842
22 6B3V 7DQ 2.36842
23 1SQK ADP 2.38727
24 4B1W ATP 2.39362
25 4B1X ATP 2.39362
26 3U9Z ADP 2.4
27 3SJH ATP 2.4
28 3SJH LAR 2.4
29 2FXU ATP 2.4
30 4H03 ATP 2.4
31 4H03 LAR 2.4
32 5YPU ATP 2.44565
33 2QXL ATP 2.46085
34 1Q9I FAD 2.46085
35 1Q9I TEO 2.46085
36 5ZZA ATP 2.47934
37 3MN5 ATP 2.50696
38 4NAE 1GP 2.66667
39 4B9Q ATP 2.68456
40 2W41 ADP 2.68456
41 4M3P HCS 2.70936
42 5CIC 51R 2.77778
43 4A2A ATP 2.86396
44 4A2B AGS 2.86396
45 1KXP ATP 2.90828
46 4XFM THE 2.90828
47 2V7Y ADP 3.13199
48 1NAA 6FA 3.13199
49 1NAA ABL 3.13199
50 2DBX GLU 3.15789
51 6EK3 OUL 3.16742
52 4EFH ADP 3.2
53 2HIM ASP 3.35196
54 4A59 AMP 3.3557
55 2BUP ADP 3.41207
56 2BUP ATP 3.41207
57 5HTX ADP 3.41686
58 3VGL ANP 3.42679
59 2YCH ATP 3.44828
60 3B8I OXL 3.48432
61 3WQT ANP 3.57942
62 5OBU ANP 3.57942
63 2E2P ADP 3.67893
64 1K7V NAG GAL BGC 3.76344
65 5G6U TRP 3.83142
66 3ITJ FAD 3.84615
67 2ZUX RAM 4.02685
68 3QFU ADP 4.06091
69 5AR0 GB8 4.06091
70 3N8K D1X 4.06977
71 5D63 FUC GLA GLA 4.09556
72 4MOP 2H5 4.10742
73 4BR5 ANP 4.15755
74 5C9P FUC 4.19948
75 6G3R ADP 4.21053
76 5OBY ANP 4.27807
77 2FAV APR 4.44444
78 6H3O FAD 4.47427
79 2Q97 ATP 4.65116
80 5FPE 3TR 4.65116
81 5EB4 FAD 4.69799
82 5VNB ALA THR ALY ALA ALA ARG ALY SER ALA PRO 4.72973
83 5JIC ADP 4.7619
84 5JIC N7E 4.7619
85 2R4J FAD 4.9217
86 2R4J 13P 4.9217
87 5DNC ASN 4.9217
88 4DDY DN6 4.94297
89 3U4L ATP 5
90 1TUU ADP 5.01253
91 1TUU AMP 5.01253
92 2PAV ATP 5.03597
93 3AAQ ARU 5.09915
94 3MN7 ATP 5.10204
95 4CNK MEU 5.11509
96 2PZE ATP 5.24017
97 2D24 XYS XYS 5.27523
98 2RDK MAN MAN 5.50459
99 2UYT LRH 5.59284
100 2UYT ADP 5.59284
101 4R8L ASP 5.71429
102 4Z94 ATP 5.82822
103 4PKI ATP 5.8642
104 2V51 ATP 6.25
105 3GUZ PAF 6.25
106 4AVV CD 6.37255
107 2Q7V FAD 6.46154
108 3P13 RIP 6.4877
109 4YKG FAD 7.15884
110 4YKG NAD 7.15884
111 3HP8 SUC 7.27273
112 3LA3 2FT 7.40741
113 3WW2 SF9 7.42188
114 4CZG ADP 7.47126
115 4CZG QH3 7.47126
116 3I9U DTU 7.60456
117 1SAZ ACP 7.61155
118 5EOU ATP 7.7957
119 1NVM OXL 7.82609
120 3F8D FAD 8.04954
121 4YDU ADP 8.2774
122 2W5P CL8 8.72483
123 1PFK ADP 8.75
124 3LDQ 3P1 8.77193
125 2A42 ATP 9.23077
126 2A3Z ATP 9.23077
127 2D1K ATP 9.23077
128 3KIF GDL 9.43396
129 4PL8 ATP 9.58904
130 4JNE ATP 9.61969
131 5ZZB ATP 10.2941
132 2X0K PPV 10.9467
133 6EOF ADP 11.1857
134 2PBD ATP 11.6279
135 6ASY ATP 11.6331
136 5YEE ATP 11.7647
137 1V1A KDG 11.9741
138 4EHU ANP 12.3188
139 2FF6 ATP 12.6667
140 2FF3 ATP 12.6667
141 5LJW ANP 12.9683
142 5EXW 7DT 13
143 2D0O ADP 13.6
144 4GNI ATP 13.6919
145 2QWO ADP 14.1304
146 3CIP ATP 14.8438
147 4PKG ATP 15.0538
148 1YAG ATP 15.2
149 2IVN ANP 15.4545
150 4YEE 4CQ 15.5556
151 5C2N NAG 16.6667
152 4BGB ADP 18.4615
153 2A40 ATP 21.875
154 2YVJ FAD 26.6055
155 4CBX ATP 26.7717
156 4CBU ATP 26.7717
157 4B1V ATP 31.25
158 4B1V LAB 31.25
159 4MO4 ACP 45.283
Pocket No.: 2; Query (leader) PDB : 4ZLU; Ligand: ADP; Similar sites found with APoc: 112
This union binding pocket(no: 2) in the query (biounit: 4zlu.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
1 6BKL EU7 None
2 6BKL RIM None
3 5U32 GDP 1.27119
4 5ERM 210 1.37741
5 5OD2 GLC 1.566
6 3LKF PC 1.67224
7 5LA1 XYP 1.78971
8 3R75 BEZ 1.78971
9 4WCX MET 1.78971
10 5ZXD ATP 2.01342
11 4FFG 0U8 2.03252
12 1A78 TDG 2.23881
13 5MB4 NAG 2.24439
14 1M0S CIT 2.28311
15 5KJW 53C 2.34192
16 3WV6 GAL BGC 2.36486
17 3WV6 GAL GLC 2.36486
18 4GA6 AMP 2.46085
19 6D61 4AA 2.5641
20 1WPQ 13P 2.5788
21 2OEM 1AE 2.66344
22 1I1E DM2 2.71318
23 4UP4 GAL NAG 2.74314
24 4UP4 NDG 2.74314
25 4UP4 NAG 2.74314
26 2JK0 ASP 2.76923
27 2Z49 AMG 2.77778
28 2GN3 MMA 2.77778
29 5D9G GLU ASN LEU TYR PHE GLN 2.84553
30 1SLT NDG GAL 2.98507
31 6CI9 F3V 3.0888
32 2AEB ABH 3.10559
33 4E8C GAL 3.13199
34 3DX5 DHB 3.14685
35 3W68 4PT 3.38346
36 5LUN ARG 3.40909
37 2WE5 ADP 3.54839
38 3MBC NAP 3.57942
39 5DG2 GAL GLC 3.7037
40 3KJM 245 3.80313
41 2VAR KDG 3.83387
42 2VAR KDF 3.83387
43 3ITJ CIT 3.84615
44 1ONX ASP 3.84615
45 2F5X ASP 3.84615
46 4TQK NAG 3.94089
47 3GXZ NAG NAG BMA MAN MAN MAN MAN MAN MAN MAN 3.9604
48 2HK9 SKM 4
49 1D3V ABH 4.02477
50 4YJ1 ADP 4.02685
51 5FBK TCR 4.02685
52 6F5W KG1 4.06504
53 4G5H UD7 4.13223
54 3WXL ADP 4.25056
55 1VKF CIT 4.25532
56 3LM9 ADP 4.30464
57 1RTF BEN 4.36508
58 5TCI MLI 4.39024
59 6FOG OXL 4.46429
60 6DW2 HD4 4.64135
61 1VC9 ATP 4.7619
62 2AL2 PEP 4.81651
63 5ZJ5 GDP 4.93827
64 1M5W DXP 4.93827
65 3VV1 GAL FUC 5
66 1TUU PIS 5.01253
67 5DYO FLU 5.04587
68 4AQ0 DMJ 5.36913
69 1K1Y ACR 5.36913
70 5HX1 UMP 5.7971
71 3ZJX BOG 5.88235
72 5L2R MLA 6.04027
73 4GKY MAN 6.13027
74 1WW5 SGA BGC 6.25
75 1JJV ATP 6.31068
76 5H9Q TD2 6.45161
77 1V59 NAD 6.4877
78 3CF6 SP1 6.71141
79 5EZU MYR 6.74157
80 4E03 ADP 6.79612
81 5MQW GTP 6.85484
82 5MQW ATP 6.85484
83 4ZV1 ARG 6.86695
84 2D6M LBT 6.91824
85 1T3D CYS 6.92042
86 3BF1 ADP 7.22892
87 3BF1 PAU 7.22892
88 5FPN KYD 7.38255
89 1LNX URI 7.40741
90 4MZU TYD 7.60626
91 1PWB GLC 7.9096
92 4RKX 3S9 8.04598
93 5VNF VAL THR SER VAL VAL 8.28025
94 1I7Q BEZ 8.80829
95 5F90 GLA GAL 8.97436
96 2BHW XAT 9.91379
97 2YMZ LAT 10
98 4XZ3 ACP 10
99 3KFF XBT 10.4938
100 3KFF ZBT 10.4938
101 1TL2 NDG 11.4407
102 2G30 ALA ALA PHE 11.6279
103 3HCH RSM 11.6438
104 1XPJ TLA 11.9048
105 3ZIA ADP 12.6984
106 4JEJ 1GP 12.7049
107 4WVW SLT 14.5833
108 3V0H I3P 15.3392
109 1DZK PRZ 15.9236
110 5NLD LBT 16.5468
111 3M3E GAL A2G NPO 17.3913
112 2JBH 5GP 19.1111
Pocket No.: 3; Query (leader) PDB : 4ZLU; Ligand: 4PW; Similar sites found with APoc: 215
This union binding pocket(no: 3) in the query (biounit: 4zlu.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
1 6BKL EU7 None
2 6BKL RIM None
3 5U32 GDP 1.27119
4 3AKI AH8 1.34228
5 5ERM 210 1.37741
6 4A62 ANP 1.5625
7 5OD2 GLC 1.566
8 3LKF PC 1.67224
9 5LA1 XYP 1.78971
10 3R75 BEZ 1.78971
11 4WCX MET 1.78971
12 5LY3 ADP 1.85185
13 3MN6 ATP 1.87166
14 3MN9 ATP 1.87166
15 5ZXD ATP 2.01342
16 4FFG 0U8 2.03252
17 2ZGY GDP 2.1875
18 1A78 TDG 2.23881
19 5MB4 NAG 2.24439
20 1M0S CIT 2.28311
21 5KJW 53C 2.34192
22 3WV6 GAL BGC 2.36486
23 3WV6 GAL GLC 2.36486
24 6B3V 7DQ 2.36842
25 6B3V ANP 2.36842
26 1SQK ADP 2.38727
27 4B1W ATP 2.39362
28 4B1X ATP 2.39362
29 3SJH ATP 2.4
30 3U9Z ADP 2.4
31 2FXU ATP 2.4
32 3SJH LAR 2.4
33 4H03 ATP 2.4
34 4H03 LAR 2.4
35 5YPU ATP 2.44565
36 2QXL ATP 2.46085
37 4GA6 AMP 2.46085
38 5ZZA ATP 2.47934
39 3MN5 ATP 2.50696
40 6D61 4AA 2.5641
41 1WPQ 13P 2.5788
42 2OEM 1AE 2.66344
43 2W41 ADP 2.68456
44 4B9Q ATP 2.68456
45 1I1E DM2 2.71318
46 4UP4 GAL NAG 2.74314
47 4UP4 NDG 2.74314
48 4UP4 NAG 2.74314
49 2JK0 ASP 2.76923
50 2Z49 AMG 2.77778
51 2GN3 MMA 2.77778
52 5D9G GLU ASN LEU TYR PHE GLN 2.84553
53 4A2A ATP 2.86396
54 4A2B AGS 2.86396
55 1KXP ATP 2.90828
56 1SLT NDG GAL 2.98507
57 6CI9 F3V 3.0888
58 2AEB ABH 3.10559
59 2V7Y ADP 3.13199
60 4E8C GAL 3.13199
61 3DX5 DHB 3.14685
62 6EK3 OUL 3.16742
63 4EFH ADP 3.2
64 2HIM ASP 3.35196
65 4A59 AMP 3.3557
66 3W68 4PT 3.38346
67 5LUN ARG 3.40909
68 2BUP ATP 3.41207
69 2BUP ADP 3.41207
70 5HTX ADP 3.41686
71 3VGL ANP 3.42679
72 2YCH ATP 3.44828
73 2WE5 ADP 3.54839
74 3WQT ANP 3.57942
75 5OBU ANP 3.57942
76 3MBC NAP 3.57942
77 2E2P ADP 3.67893
78 5DG2 GAL GLC 3.7037
79 3KJM 245 3.80313
80 5G6U TRP 3.83142
81 2VAR KDG 3.83387
82 2VAR KDF 3.83387
83 3ITJ CIT 3.84615
84 1ONX ASP 3.84615
85 2F5X ASP 3.84615
86 4TQK NAG 3.94089
87 3GXZ NAG NAG BMA MAN MAN MAN MAN MAN MAN MAN 3.9604
88 2HK9 SKM 4
89 1D3V ABH 4.02477
90 4YJ1 ADP 4.02685
91 5FBK TCR 4.02685
92 3QFU ADP 4.06091
93 5AR0 GB8 4.06091
94 6F5W KG1 4.06504
95 5D63 FUC GLA GLA 4.09556
96 4G5H UD7 4.13223
97 5C9P FUC 4.19948
98 6G3R ADP 4.21053
99 3WXL ADP 4.25056
100 1VKF CIT 4.25532
101 5OBY ANP 4.27807
102 3LM9 ADP 4.30464
103 1RTF BEN 4.36508
104 5TCI MLI 4.39024
105 6FOG OXL 4.46429
106 6DW2 HD4 4.64135
107 2Q97 ATP 4.65116
108 5FPE 3TR 4.65116
109 5JIC N7E 4.7619
110 5JIC ADP 4.7619
111 1VC9 ATP 4.7619
112 2AL2 PEP 4.81651
113 5ZJ5 GDP 4.93827
114 1M5W DXP 4.93827
115 3U4L ATP 5
116 3VV1 GAL FUC 5
117 1TUU AMP 5.01253
118 1TUU PIS 5.01253
119 1TUU ADP 5.01253
120 2PAV ATP 5.03597
121 5DYO FLU 5.04587
122 3MN7 ATP 5.10204
123 4AQ0 DMJ 5.36913
124 1K1Y ACR 5.36913
125 2RDK MAN MAN 5.50459
126 2UYT ADP 5.59284
127 2UYT LRH 5.59284
128 5HX1 UMP 5.7971
129 4Z94 ATP 5.82822
130 4PKI ATP 5.8642
131 3ZJX BOG 5.88235
132 5L2R MLA 6.04027
133 4GKY MAN 6.13027
134 2V51 ATP 6.25
135 1WW5 SGA BGC 6.25
136 3GUZ PAF 6.25
137 1JJV ATP 6.31068
138 5H9Q TD2 6.45161
139 3P13 RIP 6.4877
140 1V59 NAD 6.4877
141 3CF6 SP1 6.71141
142 5EZU MYR 6.74157
143 4E03 ADP 6.79612
144 5MQW ATP 6.85484
145 5MQW GTP 6.85484
146 4ZV1 ARG 6.86695
147 2D6M LBT 6.91824
148 1T3D CYS 6.92042
149 3BF1 ADP 7.22892
150 3BF1 PAU 7.22892
151 3HP8 SUC 7.27273
152 5FPN KYD 7.38255
153 1LNX URI 7.40741
154 4CZG ADP 7.47126
155 4CZG QH3 7.47126
156 3I9U DTU 7.60456
157 4MZU TYD 7.60626
158 1SAZ ACP 7.61155
159 5EOU ATP 7.7957
160 1PWB GLC 7.9096
161 4RKX 3S9 8.04598
162 4YDU ADP 8.2774
163 5VNF VAL THR SER VAL VAL 8.28025
164 1PFK ADP 8.75
165 3LDQ 3P1 8.77193
166 1I7Q BEZ 8.80829
167 5F90 GLA GAL 8.97436
168 2A3Z ATP 9.23077
169 2A42 ATP 9.23077
170 2D1K ATP 9.23077
171 3KIF GDL 9.43396
172 4PL8 ATP 9.58904
173 4JNE ATP 9.61969
174 2BHW XAT 9.91379
175 2YMZ LAT 10
176 4XZ3 ACP 10
177 5ZZB ATP 10.2941
178 3KFF ZBT 10.4938
179 3KFF XBT 10.4938
180 6EOF ADP 11.1857
181 1TL2 NDG 11.4407
182 2PBD ATP 11.6279
183 2G30 ALA ALA PHE 11.6279
184 6ASY ATP 11.6331
185 3HCH RSM 11.6438
186 5YEE ATP 11.7647
187 1XPJ TLA 11.9048
188 4EHU ANP 12.3188
189 2FF6 ATP 12.6667
190 2FF3 ATP 12.6667
191 3ZIA ADP 12.6984
192 4JEJ 1GP 12.7049
193 5LJW ANP 12.9683
194 5EXW 7DT 13
195 2D0O ADP 13.6
196 4GNI ATP 13.6919
197 2QWO ADP 14.1304
198 4WVW SLT 14.5833
199 3CIP ATP 14.8438
200 4PKG ATP 15.0538
201 1YAG ATP 15.2
202 3V0H I3P 15.3392
203 2IVN ANP 15.4545
204 1DZK PRZ 15.9236
205 5NLD LBT 16.5468
206 5C2N NAG 16.6667
207 3M3E GAL A2G NPO 17.3913
208 4BGB ADP 18.4615
209 2JBH 5GP 19.1111
210 2A40 ATP 21.875
211 4CBU ATP 26.7717
212 4CBX ATP 26.7717
213 4B1V ATP 31.25
214 4B1V LAB 31.25
215 4MO4 ACP 45.283
Pocket No.: 4; Query (leader) PDB : 4ZLU; Ligand: 4PW; Similar sites found with APoc: 36
This union binding pocket(no: 4) in the query (biounit: 4zlu.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
1 5T63 ALA ALA ALA ALA 1.90736
2 5O22 C3R 2.07612
3 4D62 SIA 2.13904
4 4XFR CIT 2.34192
5 5YJS SAL 2.5641
6 2DUR MAN MAN 2.7668
7 1VAY AZA 2.78746
8 4XFM THE 2.90828
9 4LOC OXM 3.13199
10 6I6R H62 3.13199
11 2DBX GLU 3.15789
12 2I4O ATP 3.3557
13 5LY1 PPI 3.41207
14 1LSH PLD 3.44828
15 3B8I OXL 3.48432
16 2IYL GDP 3.52113
17 4J25 OGA 3.93013
18 4BR5 ANP 4.15755
19 1R0X ATP 4.1958
20 4ISS TAR 4.25056
21 6E1Q CFA 4.47427
22 5VNB ALA THR ALY ALA ALA ARG ALY SER ALA PRO 4.72973
23 3I8T LBT 4.87805
24 3AAQ ARU 5.09915
25 3KIH GDL 5.15464
26 5LV1 78T 5.35714
27 4K55 H6P 5.64516
28 6GNO XDI 6.66667
29 3WW2 SF9 7.42188
30 1NVM OXL 7.82609
31 3SAO DBH 8.125
32 2W5P CL8 8.72483
33 2EB5 OXL 10.1124
34 3KPE TM3 10.2564
35 5TQZ GLC 13.3333
36 4YEE 4CQ 15.5556
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