Receptor
PDB id Resolution Class Description Source Keywords
5N53 1.48 Å EC: 1.1.1.95 CRYSTAL STRUCTURE OF HUMAN 3-PHOSPHOGLYCERATE DEHYDROGENASE WITH N-(3-CHLORO-4-METHOXYPHENYL) ACETAMIDE HOMO SAPIENS DEHYDROGENASE SERINE METABOLISM FBDD OXIDOREDUCTASE
Ref.: VALIDATING AND ENABLING PHOSPHOGLYCERATE DEHYDROGEN (PHGDH) AS A TARGET FOR FRAGMENT-BASED DRUG DISCOVE PHGDH-AMPLIFIED BREAST CANCER. ONCOTARGET V. 9 13139 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
8NB A:301;
B:301;
Valid;
Valid;
none;
none;
Kd = 2.8 mM
199.634 C9 H10 Cl N O2 CC(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5N53 1.48 Å EC: 1.1.1.95 CRYSTAL STRUCTURE OF HUMAN 3-PHOSPHOGLYCERATE DEHYDROGENASE WITH N-(3-CHLORO-4-METHOXYPHENYL) ACETAMIDE HOMO SAPIENS DEHYDROGENASE SERINE METABOLISM FBDD OXIDOREDUCTASE
Ref.: VALIDATING AND ENABLING PHOSPHOGLYCERATE DEHYDROGEN (PHGDH) AS A TARGET FOR FRAGMENT-BASED DRUG DISCOVE PHGDH-AMPLIFIED BREAST CANCER. ONCOTARGET V. 9 13139 2018
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 5N53 Kd = 2.8 mM 8NB C9 H10 Cl N O2 CC(=O)Nc1c....
2 5NZP Kd = 6.5 mM 9EW C7 H5 N O2 c1ccc2c(c1....
70% Homology Family (12)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 5N53 Kd = 2.8 mM 8NB C9 H10 Cl N O2 CC(=O)Nc1c....
2 5NZP Kd = 6.5 mM 9EW C7 H5 N O2 c1ccc2c(c1....
3 6CWA - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
4 6RJ6 ic50 = 2 nM K5K C21 H20 Cl2 N2 O6 S Cc1cc2c(cc....
5 6RJ2 ic50 = 0.1 uM K52 C21 H22 N4 O4 S C[C@H](c1c....
6 6RIH Kd = 105 uM K4T C14 H15 N3 O Cn1c(cc(n1....
7 6PLF ic50 = 0.238 uM ONV C22 H20 Cl N3 O7 c1cc(ccc1[....
8 6RJ3 ic50 = 0.4 uM K58 C20 H19 N3 O3 C[C@H](c1c....
9 6RJ5 ic50 = 0.3 uM K5N C21 H22 N4 O4 S C[C@H](c1c....
10 5N6C Ka = 22500 M^-1 NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
11 5OFV Kd = 26.2 mM 9TZ C8 H7 F O2 Cc1ccc(cc1....
12 5OFW Kd = 1.6 mM 9TW C7 H5 Cl F N O c1cc(c(cc1....
50% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 225 families.
1 5N53 Kd = 2.8 mM 8NB C9 H10 Cl N O2 CC(=O)Nc1c....
2 4E5M - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 4E5N - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 4E5K - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 6RJ6 ic50 = 2 nM K5K C21 H20 Cl2 N2 O6 S Cc1cc2c(cc....
6 6RJ2 ic50 = 0.1 uM K52 C21 H22 N4 O4 S C[C@H](c1c....
7 5OFV Kd = 26.2 mM 9TZ C8 H7 F O2 Cc1ccc(cc1....
8 5OFW Kd = 1.6 mM 9TW C7 H5 Cl F N O c1cc(c(cc1....
9 2DBQ - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 5AOV - GLV C2 H2 O3 C(=O)C(=O)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 8NB; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 8NB 1 1
2 EE8 0.644444 0.857143
3 T9V 0.418605 0.806452
Similar Ligands (3D)
Ligand no: 1; Ligand: 8NB; Similar ligands found: 835
No: Ligand Similarity coefficient
1 GF4 0.9616
2 3VX 0.9557
3 CXH 0.9535
4 N91 0.9525
5 ALE 0.9490
6 TYL 0.9456
7 4BL 0.9447
8 LDP 0.9446
9 4BY 0.9445
10 428 0.9443
11 N4E 0.9439
12 N7I 0.9436
13 42J 0.9432
14 3ZB 0.9415
15 YTX 0.9403
16 Y3L 0.9397
17 RKV 0.9397
18 GO2 0.9387
19 J6W 0.9380
20 6KT 0.9380
21 P80 0.9370
22 8NX 0.9328
23 UNJ 0.9321
24 NAG 0.9315
25 F2W 0.9308
26 3QV 0.9306
27 MPV 0.9296
28 NDG 0.9293
29 8WO 0.9293
30 X0W 0.9288
31 LSQ 0.9288
32 QIV 0.9281
33 363 0.9281
34 94W 0.9280
35 CIY 0.9279
36 JBZ 0.9277
37 4FE 0.9272
38 4XF 0.9269
39 OQC 0.9266
40 0FK 0.9262
41 K4V 0.9258
42 TYR 0.9258
43 LNR 0.9257
44 JP2 0.9257
45 9NB 0.9256
46 RA7 0.9255
47 A5E 0.9255
48 88L 0.9254
49 H7Y 0.9251
50 TYE 0.9248
51 492 0.9247
52 L99 0.9247
53 2K8 0.9247
54 AEH 0.9246
55 NFM 0.9243
56 E7S 0.9239
57 KTW 0.9237
58 0HO 0.9236
59 BZ2 0.9235
60 CFA 0.9229
61 UA5 0.9229
62 1F1 0.9227
63 MQG 0.9225
64 4I8 0.9223
65 0JD 0.9221
66 BNX 0.9217
67 ZHA 0.9217
68 GDL 0.9216
69 15N 0.9215
70 RNO 0.9215
71 12T 0.9212
72 HHS 0.9212
73 HC4 0.9211
74 0HN 0.9209
75 BPY 0.9209
76 F4K 0.9206
77 NOK 0.9205
78 1FE 0.9205
79 344 0.9205
80 9R5 0.9202
81 APS 0.9199
82 HA5 0.9196
83 2FX 0.9193
84 5LA 0.9190
85 2D2 0.9189
86 VXX 0.9188
87 CWJ 0.9186
88 TMG 0.9185
89 GZ2 0.9185
90 X0U 0.9180
91 JB8 0.9179
92 4NP 0.9176
93 SNO 0.9175
94 ESX 0.9174
95 BGU 0.9173
96 6Q3 0.9172
97 0W1 0.9171
98 PH3 0.9171
99 ICB 0.9171
100 14W 0.9169
101 0NX 0.9169
102 PNZ 0.9168
103 S60 0.9167
104 M78 0.9167
105 BPN 0.9164
106 TWO 0.9163
107 R20 0.9162
108 XCG 0.9162
109 MSR 0.9161
110 ESI 0.9161
111 ESP 0.9160
112 K82 0.9160
113 JAW 0.9156
114 JCZ 0.9156
115 ANN 0.9155
116 PPY 0.9153
117 C82 0.9152
118 6FZ 0.9152
119 4WL 0.9149
120 15E 0.9148
121 9ZE 0.9146
122 8U3 0.9145
123 6FB 0.9145
124 L22 0.9144
125 4MB 0.9142
126 AJG 0.9142
127 4FF 0.9139
128 I3E 0.9139
129 92P 0.9137
130 V1T 0.9134
131 8W9 0.9134
132 9FE 0.9134
133 78Y 0.9132
134 J9N 0.9131
135 2QC 0.9131
136 80G 0.9128
137 M5H 0.9127
138 TSS 0.9125
139 AZM 0.9122
140 6SD 0.9119
141 JDN 0.9119
142 M4E 0.9118
143 CHB 0.9116
144 D3G 0.9115
145 IHB 0.9113
146 3A9 0.9112
147 YRL 0.9112
148 AH9 0.9111
149 FDR 0.9111
150 PO6 0.9108
151 HNT 0.9108
152 MD6 0.9106
153 4FA 0.9103
154 E1T 0.9103
155 8ZE 0.9102
156 6RQ 0.9100
157 F02 0.9097
158 3R4 0.9097
159 A7N 0.9097
160 SNU 0.9096
161 NGA 0.9094
162 RCV 0.9092
163 BQ2 0.9092
164 6NI 0.9092
165 6NT 0.9091
166 2ZM 0.9091
167 2A9 0.9090
168 ST3 0.9090
169 2HC 0.9087
170 795 0.9087
171 GWM 0.9087
172 6TZ 0.9085
173 IAC 0.9085
174 ARP 0.9084
175 3VS 0.9081
176 A7H 0.9079
177 H4E 0.9078
178 3NY 0.9078
179 KMY 0.9077
180 MPP 0.9075
181 8HC 0.9074
182 X48 0.9073
183 N3W 0.9068
184 TR4 0.9064
185 FF2 0.9064
186 BZE 0.9064
187 VC3 0.9063
188 LQ2 0.9061
189 5TZ 0.9061
190 CPZ 0.9060
191 4NB 0.9058
192 QSB 0.9057
193 DHY 0.9054
194 CNI 0.9053
195 A6W 0.9050
196 DHC 0.9049
197 549 0.9049
198 61M 0.9049
199 PH2 0.9046
200 TCA 0.9046
201 4BZ 0.9046
202 INO 0.9045
203 ZYQ 0.9045
204 MMJ 0.9043
205 4LW 0.9042
206 AMR 0.9041
207 27B 0.9041
208 DVQ 0.9040
209 7O4 0.9040
210 4XS 0.9038
211 P81 0.9038
212 JLZ 0.9038
213 R9Y 0.9038
214 DHB 0.9038
215 E5X 0.9038
216 S0E 0.9037
217 XIY 0.9037
218 SKM 0.9037
219 36Y 0.9036
220 4YO 0.9036
221 VOH 0.9036
222 HHR 0.9035
223 OGA 0.9035
224 N2I 0.9034
225 LO1 0.9033
226 5TY 0.9033
227 4NS 0.9032
228 IWT 0.9031
229 TZF 0.9030
230 L5V 0.9029
231 HX4 0.9029
232 F31 0.9028
233 F4E 0.9026
234 HQJ 0.9025
235 2O8 0.9025
236 AKG 0.9024
237 ALX 0.9023
238 4ZA 0.9021
239 N2M 0.9021
240 OHJ 0.9018
241 ANC 0.9018
242 PNP 0.9017
243 4V2 0.9016
244 G14 0.9016
245 GO8 0.9016
246 FER 0.9012
247 MAJ 0.9012
248 L14 0.9011
249 ZEC 0.9010
250 AY4 0.9009
251 93K 0.9008
252 HJ7 0.9008
253 6QF 0.9007
254 KYA 0.9007
255 GNM 0.9005
256 EUE 0.9005
257 1M2 0.9004
258 2BX 0.9004
259 5NI 0.9002
260 XDK 0.9000
261 4TU 0.8998
262 2HU 0.8997
263 EN1 0.8997
264 BP7 0.8996
265 XDE 0.8995
266 SYV 0.8995
267 HCI 0.8993
268 GJP 0.8993
269 4P5 0.8993
270 FHC 0.8992
271 CH9 0.8991
272 ES2 0.8991
273 TGX 0.8991
274 YPN 0.8990
275 ABI 0.8990
276 IQ5 0.8987
277 C1M 0.8987
278 GJK 0.8987
279 BL0 0.8986
280 JAH 0.8986
281 2HO 0.8986
282 9TW 0.8985
283 4NC 0.8985
284 7MW 0.8981
285 36M 0.8980
286 5GT 0.8980
287 3C4 0.8980
288 ZZA 0.8979
289 VGD 0.8978
290 4JQ 0.8977
291 VM1 0.8976
292 EWG 0.8976
293 X6W 0.8975
294 A5P 0.8975
295 DHR 0.8975
296 P9P 0.8973
297 K2T 0.8971
298 YOF 0.8969
299 JA8 0.8969
300 1FD 0.8968
301 3HM 0.8968
302 MYJ 0.8968
303 GZL 0.8966
304 HBO 0.8966
305 P7Y 0.8965
306 HRM 0.8965
307 J9Q 0.8964
308 86L 0.8964
309 8WT 0.8963
310 2GQ 0.8963
311 S98 0.8963
312 4NM 0.8962
313 3VQ 0.8962
314 TT4 0.8961
315 2O6 0.8960
316 OTR 0.8960
317 5F5 0.8960
318 MXD 0.8958
319 HPP 0.8958
320 FHB 0.8958
321 XIZ 0.8958
322 ZYR 0.8957
323 4A3 0.8955
324 RP3 0.8955
325 EVF 0.8954
326 TTL 0.8954
327 ICO 0.8953
328 FBB 0.8951
329 3W8 0.8950
330 MS9 0.8949
331 AN3 0.8948
332 IOP 0.8947
333 3PF 0.8945
334 B1J 0.8944
335 PPT 0.8943
336 5QY 0.8943
337 LR5 0.8940
338 36E 0.8940
339 AX3 0.8939
340 92G 0.8937
341 A98 0.8937
342 NNO 0.8936
343 2F6 0.8936
344 B4O 0.8935
345 LEL 0.8935
346 PQK 0.8933
347 EMZ 0.8932
348 GDE 0.8931
349 6ZW 0.8931
350 VNL 0.8931
351 54X 0.8930
352 LL1 0.8930
353 MQN 0.8929
354 2JK 0.8928
355 ENO 0.8927
356 K7H 0.8927
357 ODK 0.8926
358 JFJ 0.8925
359 AMH 0.8925
360 2KA 0.8925
361 SKF 0.8924
362 1P8 0.8924
363 4RU 0.8923
364 4AA 0.8922
365 JG8 0.8921
366 DJN 0.8921
367 5VM 0.8920
368 PUE 0.8920
369 7VP 0.8919
370 60L 0.8919
371 A29 0.8919
372 36R 0.8918
373 GVY 0.8918
374 MUK 0.8918
375 SLS 0.8916
376 2WU 0.8916
377 BPU 0.8916
378 KLE 0.8915
379 AH6 0.8915
380 QBM 0.8914
381 4XV 0.8913
382 SG2 0.8913
383 7MX 0.8912
384 68A 0.8911
385 HX3 0.8911
386 0TU 0.8910
387 2BG 0.8910
388 S2G 0.8909
389 DNF 0.8909
390 5GV 0.8909
391 PZM 0.8908
392 S0W 0.8906
393 5XC 0.8905
394 EXD 0.8905
395 ZME 0.8905
396 5GU 0.8905
397 HDH 0.8904
398 PD2 0.8904
399 0F9 0.8903
400 S0D 0.8903
401 259 0.8903
402 2FQ 0.8902
403 M3P 0.8902
404 9FL 0.8902
405 M6Z 0.8902
406 ITE 0.8901
407 BZJ 0.8900
408 CLW 0.8899
409 657 0.8898
410 FQX 0.8896
411 LJ3 0.8895
412 DAH 0.8895
413 KJU 0.8894
414 RD4 0.8893
415 MP5 0.8892
416 6ME 0.8891
417 AEF 0.8889
418 FUD 0.8888
419 5RP 0.8888
420 2HG 0.8887
421 C2Y 0.8886
422 FYR 0.8885
423 BIK 0.8885
424 A5H 0.8885
425 IOS 0.8885
426 7ME 0.8884
427 E3X 0.8880
428 SSB 0.8879
429 DZA 0.8879
430 MZM 0.8878
431 5OO 0.8877
432 8XL 0.8876
433 1HN 0.8876
434 IYR 0.8875
435 1EB 0.8874
436 4JC 0.8874
437 D2G 0.8873
438 NF3 0.8872
439 KOJ 0.8871
440 ZRK 0.8870
441 ZSP 0.8870
442 AMS 0.8870
443 EV0 0.8869
444 9FH 0.8868
445 FZM 0.8866
446 TSR 0.8865
447 W81 0.8865
448 ET2 0.8864
449 4R1 0.8864
450 QSH 0.8864
451 BDP 0.8863
452 ST2 0.8863
453 W29 0.8862
454 KTJ 0.8861
455 L03 0.8860
456 QX4 0.8859
457 D48 0.8859
458 5H6 0.8859
459 CTE 0.8859
460 STT 0.8858
461 PHE 0.8858
462 1BW 0.8858
463 J9T 0.8858
464 4NZ 0.8857
465 AJ1 0.8857
466 BNL 0.8856
467 AVX 0.8855
468 S7S 0.8855
469 GLN 0.8853
470 3AE 0.8853
471 DDU 0.8853
472 PFF 0.8853
473 DTY 0.8852
474 FBF 0.8852
475 1A7 0.8851
476 5RO 0.8851
477 J5I 0.8850
478 KDV 0.8850
479 E4P 0.8849
480 5JL 0.8847
481 1L5 0.8847
482 F40 0.8847
483 JMG 0.8846
484 5SP 0.8846
485 I2E 0.8845
486 DK1 0.8845
487 0UL 0.8845
488 7WR 0.8845
489 ASC 0.8842
490 0SY 0.8841
491 7FU 0.8841
492 EUG 0.8839
493 0LO 0.8839
494 LGT 0.8839
495 1Z6 0.8838
496 7MU 0.8837
497 YE6 0.8837
498 XX2 0.8837
499 QBK 0.8837
500 PRZ 0.8837
501 FTV 0.8836
502 9BF 0.8836
503 H4B 0.8833
504 AES 0.8833
505 4HM 0.8830
506 GLO 0.8829
507 3Y7 0.8829
508 CK2 0.8828
509 DHK 0.8826
510 2J1 0.8825
511 MUR 0.8825
512 ONR 0.8824
513 9CA 0.8823
514 GCO 0.8821
515 NY4 0.8821
516 ODO 0.8820
517 PIY 0.8820
518 HHH 0.8820
519 5O6 0.8820
520 TU0 0.8819
521 X0V 0.8819
522 GVG 0.8817
523 BZ3 0.8816
524 1VK 0.8816
525 CS2 0.8815
526 4CM 0.8815
527 4G2 0.8815
528 BIO 0.8813
529 M4S 0.8813
530 44V 0.8812
531 DRG 0.8811
532 G3E 0.8811
533 V55 0.8811
534 YI6 0.8810
535 CKA 0.8810
536 55D 0.8810
537 SSC 0.8810
538 R2P 0.8806
539 8TX 0.8805
540 KTA 0.8805
541 OW7 0.8805
542 RVE 0.8804
543 DQU 0.8803
544 SE2 0.8803
545 4MU 0.8802
546 KF5 0.8802
547 1IT 0.8799
548 G6P 0.8797
549 PIM 0.8796
550 F9Y 0.8796
551 BBK 0.8795
552 IS2 0.8795
553 XAZ 0.8794
554 2FY 0.8794
555 PJW 0.8794
556 ABF 0.8793
557 833 0.8793
558 4SX 0.8792
559 HHI 0.8791
560 YE7 0.8789
561 4BF 0.8789
562 B62 0.8788
563 B55 0.8787
564 75K 0.8787
565 2CZ 0.8787
566 0BP 0.8787
567 N8Y 0.8786
568 PRL 0.8785
569 OTW 0.8785
570 OW4 0.8784
571 AJY 0.8783
572 PHB 0.8783
573 HSX 0.8782
574 HPT 0.8782
575 JTA 0.8782
576 K25 0.8780
577 268 0.8779
578 B21 0.8779
579 QBP 0.8779
580 GLC 0.8778
581 52C 0.8776
582 5OB 0.8775
583 463 0.8775
584 L15 0.8775
585 069 0.8774
586 AM4 0.8772
587 5F8 0.8770
588 2J2 0.8770
589 MTL 0.8770
590 EZL 0.8769
591 THA 0.8769
592 OVM 0.8769
593 FMQ 0.8769
594 173 0.8769
595 LVD 0.8768
596 C53 0.8768
597 NOJ 0.8768
598 TCR 0.8767
599 3XR 0.8765
600 HIS 0.8765
601 717 0.8765
602 SWX 0.8765
603 JGB 0.8765
604 GAL 0.8764
605 9UL 0.8764
606 MR1 0.8763
607 A2G 0.8763
608 6MW 0.8763
609 DEW 0.8763
610 N0Z 0.8762
611 YZM 0.8762
612 D6G 0.8762
613 AC6 0.8759
614 2LY 0.8759
615 4FH 0.8758
616 54Z 0.8758
617 IV2 0.8756
618 97T 0.8756
619 4ME 0.8754
620 SOR 0.8753
621 92O 0.8752
622 CWD 0.8752
623 F5C 0.8751
624 GHM 0.8751
625 JA5 0.8751
626 0FR 0.8750
627 ENW 0.8750
628 FGZ 0.8749
629 TXW 0.8748
630 LR8 0.8748
631 PAB 0.8747
632 505 0.8747
633 56D 0.8747
634 5JQ 0.8745
635 X11 0.8743
636 BGC 0.8742
637 0F3 0.8741
638 HWD 0.8740
639 HQD 0.8739
640 5FL 0.8739
641 0FO 0.8737
642 DEZ 0.8736
643 4JE 0.8735
644 F0J 0.8735
645 MVN 0.8735
646 64Z 0.8735
647 OCZ 0.8732
648 P4L 0.8731
649 DXK 0.8731
650 J38 0.8730
651 KLV 0.8730
652 DE5 0.8729
653 PHU 0.8729
654 M4T 0.8729
655 7QD 0.8729
656 4VY 0.8728
657 EKZ 0.8726
658 FWD 0.8726
659 2HQ 0.8725
660 URC 0.8725
661 GNY 0.8724
662 1PS 0.8723
663 PBZ 0.8723
664 DGJ 0.8722
665 2PV 0.8722
666 TID 0.8720
667 49P 0.8720
668 S7J 0.8719
669 30G 0.8718
670 6L6 0.8718
671 6P3 0.8717
672 DNA 0.8716
673 2GS 0.8716
674 3R6 0.8716
675 PLP 0.8715
676 GNV 0.8714
677 44W 0.8713
678 XHP 0.8712
679 NPO 0.8711
680 9H2 0.8711
681 8IG 0.8710
682 BNF 0.8709
683 V2Z 0.8709
684 BGP 0.8708
685 HBD 0.8708
686 39O 0.8706
687 CSN 0.8705
688 ANF 0.8705
689 1KP 0.8705
690 BWD 0.8705
691 A5Q 0.8704
692 K3Q 0.8704
693 PAC 0.8703
694 DNQ 0.8700
695 J1K 0.8699
696 3J8 0.8698
697 8D6 0.8698
698 4MA 0.8697
699 IWD 0.8697
700 L1T 0.8695
701 86J 0.8695
702 LIP 0.8694
703 UFO 0.8693
704 IFP 0.8692
705 1ZC 0.8692
706 AA 0.8690
707 4M4 0.8688
708 K3D 0.8688
709 JTH 0.8687
710 2PK 0.8686
711 5E5 0.8686
712 0N7 0.8683
713 5RN 0.8683
714 NK5 0.8681
715 HRD 0.8680
716 PQ0 0.8676
717 CLZ 0.8676
718 8CC 0.8674
719 NCT 0.8673
720 DEE 0.8672
721 5WT 0.8671
722 G3F 0.8671
723 KDG 0.8670
724 4HB 0.8670
725 DTR 0.8667
726 5VL 0.8666
727 D8Q 0.8665
728 TZM 0.8661
729 4Z4 0.8661
730 NBG 0.8661
731 3D8 0.8660
732 AAN 0.8658
733 H42 0.8658
734 PEY 0.8657
735 CCU 0.8654
736 VFG 0.8652
737 L46 0.8652
738 QMP 0.8651
739 3DM 0.8650
740 K37 0.8649
741 OVP 0.8648
742 JYB 0.8646
743 B2J 0.8644
744 ERZ 0.8644
745 6X9 0.8642
746 YZ9 0.8641
747 KLS 0.8641
748 AJV 0.8638
749 KBZ 0.8638
750 PRA 0.8636
751 6HP 0.8635
752 TRP 0.8635
753 9AP 0.8634
754 NDD 0.8634
755 27K 0.8632
756 DIN 0.8629
757 PBA 0.8625
758 LUM 0.8623
759 209 0.8622
760 UN1 0.8621
761 IPD 0.8621
762 7I2 0.8619
763 GGB 0.8619
764 DPT 0.8619
765 SR1 0.8618
766 PZI 0.8617
767 HBI 0.8617
768 ZYX 0.8616
769 H5B 0.8614
770 CXF 0.8612
771 D1G 0.8612
772 SJK 0.8609
773 1X4 0.8609
774 9JT 0.8606
775 4XR 0.8604
776 URO 0.8604
777 KYN 0.8603
778 0K7 0.8600
779 PMP 0.8599
780 QMS 0.8598
781 AZ9 0.8597
782 NDH 0.8597
783 B85 0.8596
784 9B3 0.8596
785 MRW 0.8596
786 E0O 0.8596
787 II4 0.8596
788 2EC 0.8595
789 5SJ 0.8594
790 RP5 0.8588
791 6C8 0.8587
792 YIE 0.8585
793 IPT 0.8583
794 K32 0.8583
795 RYV 0.8583
796 9LI 0.8580
797 H2B 0.8580
798 PQZ 0.8579
799 BRH 0.8577
800 4CN 0.8576
801 DUR 0.8573
802 DGL 0.8572
803 LFQ 0.8572
804 ZRL 0.8571
805 47V 0.8570
806 DCZ 0.8570
807 BA5 0.8568
808 F6P 0.8567
809 2H5 0.8564
810 9CE 0.8563
811 6HO 0.8561
812 D5X 0.8561
813 0XT 0.8561
814 WLH 0.8558
815 3SU 0.8555
816 XI7 0.8555
817 LDC 0.8554
818 9KZ 0.8554
819 AMQ 0.8552
820 G12 0.8550
821 DMD 0.8550
822 BBY 0.8550
823 6DP 0.8545
824 MS0 0.8543
825 NKI 0.8543
826 COU 0.8542
827 GB4 0.8535
828 2AQ 0.8534
829 GLA 0.8533
830 OCH 0.8533
831 NIF 0.8532
832 EV2 0.8531
833 1V1 0.8531
834 20D 0.8506
835 ADA 0.8504
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5N53; Ligand: 8NB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 5n53.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5N53; Ligand: 8NB; 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: 5n53.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback