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Receptor
PDB id Resolution Class Description Source Keywords
5OFV 1.5 Å EC: 1.1.1.95 CRYSTAL STRUCTURE OF HUMAN 3-PHOSPHOGLYCERATE DEHYDROGENASE WITH 5-FLUORO-2-METHYLBENZOIC ACID 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
9TZ B:401;
A:401;
Valid;
Valid;
none;
none;
Kd = 26.2 mM
154.138 C8 H7 F O2 Cc1cc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5OFW 1.5 Å EC: 1.1.1.95 CRYSTAL STRUCTURE OF HUMAN 3-PHOSPHOGLYCERATE DEHYDROGENASE WITH 3-CHLORO-4-FLUOROBENZAMIDE 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 5OFV Kd = 26.2 mM 9TZ C8 H7 F O2 Cc1ccc(cc1....
2 5OFW Kd = 1.6 mM 9TW C7 H5 Cl F N O c1cc(c(cc1....
70% Homology Family (5)
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 5OFV Kd = 26.2 mM 9TZ C8 H7 F O2 Cc1ccc(cc1....
4 5OFW Kd = 1.6 mM 9TW C7 H5 Cl F N O c1cc(c(cc1....
5 5N6C Ka = 22500 M^-1 NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (5)
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 5OFV Kd = 26.2 mM 9TZ C8 H7 F O2 Cc1ccc(cc1....
4 5OFW Kd = 1.6 mM 9TW C7 H5 Cl F N O c1cc(c(cc1....
5 5N6C Ka = 22500 M^-1 NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 9TZ; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 9TZ 1 1
2 5RG 0.527778 0.607143
3 FA0 0.435897 0.607143
4 3SK 0.416667 0.722222
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5OFW; Ligand: 9TW; Similar sites found with APoc: 737
This union binding pocket(no: 1) in the query (biounit: 5ofw.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 4R57 ACO None
2 6C8X BVR None
3 4YHQ G10 None
4 4NJS G08 None
5 3T3C 017 None
6 2P3B 3TL None
7 3GGU 017 None
8 5T2Z 017 None
9 4M8X KGQ None
10 3S43 478 None
11 1PNO NAP None
12 1GHE ACO None
13 1V3S ATP None
14 2O4N TPV None
15 1IYE PGU 0.896861
16 1V35 NAI 1.34529
17 4YUW 4JU 1.34529
18 4YUW S4M 1.34529
19 4DSG UDP 1.34529
20 4DSG FAD 1.34529
21 1Q8P MAN MMA 1.34529
22 2PHW MAN MAN MAN BMA MAN MAN MAN 1.34529
23 2PHF MAN MAN BMA MAN 1.34529
24 2PHU MAN MAN MAN BMA MAN 1.34529
25 2PHR MAN MAN BMA MAN 1.34529
26 2PHT MAN MAN MAN BMA MAN 1.34529
27 2AR6 NAG MAN 1.34529
28 3A4T SFG 1.34529
29 2PHR MAN MAN 1.34529
30 2PHW MAN MAN 1.34529
31 2AUY NAG MAN MMA 1.34529
32 2PHX MAN MAN 1.34529
33 2GND MAN MMA 1.34529
34 2PHF MAN MAN 1.34529
35 5LW0 AR6 1.34529
36 1Q8O MAN MMA 1.34529
37 1Q8Q MAN MMA 1.34529
38 1UKG MMA 1.34529
39 1Q8S MAN MMA 1.34529
40 2PHU MAN MAN 1.34529
41 1Q8V MAN MAN 1.34529
42 4EUU BX7 1.34529
43 2GND MAN 1.34529
44 4EBZ NAG NAG NAG NAG 1.41509
45 5Z7B VNL 1.51515
46 1TIQ COA 1.66667
47 5O4J 9KH 1.79372
48 5O4J PJL 1.79372
49 5O4J SAH 1.79372
50 1LVL NAD 1.79372
51 5X68 FAD 1.79372
52 3NYC FAD 1.79372
53 3NYC IAR 1.79372
54 4BV6 FAD 1.79372
55 4YZC STU 1.79372
56 1ATL 0QI 1.9802
57 1DLJ NAI 2.24215
58 3Q3C NAD 2.24215
59 4USR FAD 2.24215
60 6F7L FAD 2.24215
61 3MAG SAH 2.24215
62 5JWC FAD 2.24215
63 3MCT SAH 2.24215
64 2VVM FAD 2.24215
65 2VVL FAD 2.24215
66 3K7M FAD 2.24215
67 1DLJ UGA 2.24215
68 3WMX NAD 2.24215
69 4J36 1HR 2.24215
70 1LTH NAD 2.24215
71 4J36 FAD 2.24215
72 5OJL TXP 2.24215
73 1YJQ NAP 2.24215
74 3CZ7 ACO 2.24215
75 2IYA UDP 2.24215
76 6GFK SAH 2.24215
77 5D9G GLU ASN LEU TYR PHE GLN 2.24215
78 1PL6 NAD 2.24215
79 1PL6 572 2.24215
80 2RIO ADP 2.24215
81 1KYZ SAH 2.24215
82 4RPO T6C 2.24215
83 2GJ5 VD3 2.46914
84 3OA2 NAD 2.69058
85 4ZCC FAD 2.69058
86 4ZCC NAI 2.69058
87 1X14 NAD 2.69058
88 4PLG NAI 2.69058
89 4PLG OXM 2.69058
90 6AA8 NAD 2.69058
91 1EBF NAD 2.69058
92 1H2B NAJ 2.69058
93 1RJW ETF 2.69058
94 1UXG FUM 2.69058
95 1UXG NAD 2.69058
96 1RYI GOA 2.69058
97 2NPX NAD 2.69058
98 1E5Q NDP 2.69058
99 3GFB NAD 2.69058
100 1RYI FAD 2.69058
101 5D4V SAH 2.69058
102 5GT9 NAP 2.69058
103 5MBX FAD 2.69058
104 5MBX SP5 2.69058
105 2YY7 NAD 2.69058
106 2NPX FAD 2.69058
107 1D4D FAD 2.69058
108 1U8X NAD 2.69058
109 3MB5 SAM 2.69058
110 4PLT OXM 2.69058
111 4R6W SAH 2.69058
112 1ST0 GTG 2.69058
113 1TPY SAH 2.69058
114 1AE1 NAP 2.69058
115 4PLT NAI 2.69058
116 3AI7 TPP 2.69058
117 4MFZ MFK 2.69058
118 5DK4 5BX 2.69058
119 5DK4 ATP 2.69058
120 1F0X FAD 2.69058
121 1U1F 183 2.69058
122 2Y6Q I7T 2.69058
123 2Y6Q FAD 2.69058
124 5OJI NAP 2.69058
125 5OJI ISN 2.69058
126 1KGZ PRP 2.69058
127 1M2K APR 2.69058
128 2IV3 UDP 2.69058
129 2XN2 GLA 2.69058
130 1I7A PHE 2.7027
131 4EA7 JB2 2.72727
132 4EA7 COA 2.72727
133 2ZFU SAH 2.7907
134 3H2B SAH 2.95567
135 4RGQ NDP 2.98913
136 4RGQ 1GP 2.98913
137 1KOL NAD 3.01508
138 2IXB NAD 3.13901
139 2IXB A2G 3.13901
140 2A92 NAI 3.13901
141 1C3V NDP 3.13901
142 1UP7 NAD 3.13901
143 5KVA SAM 3.13901
144 1RSG FAD 3.13901
145 2O07 SPD 3.13901
146 3WGT FAD 3.13901
147 3WGT QSC 3.13901
148 3G5S FAD 3.13901
149 3NT6 FAD 3.13901
150 2O07 MTA 3.13901
151 1V2F HCI 3.13901
152 2AE2 NAP 3.13901
153 2AE2 PTO 3.13901
154 1GZ4 ATP 3.13901
155 6DQU GLY ILE ILE ASN THR LEU 3.13901
156 1KPG SAH 3.13901
157 1SQF SAM 3.13901
158 4NTC FAD 3.13901
159 5JFL NAD 3.13901
160 1ZVW PRP 3.13901
161 1KPH SAH 3.13901
162 2I6A 5I5 3.13901
163 2NXW TPP 3.13901
164 6F97 FAD 3.13901
165 2JAP J01 3.13901
166 5IBE 69M 3.13901
167 1D6S MET PLP 3.13901
168 2W41 ADP 3.13901
169 1D6S PLP MET 3.13901
170 6EJI UD2 3.13901
171 1TB3 FMN 3.13901
172 4I42 1HA 3.13901
173 3WV8 ATP 3.21101
174 2VT3 ATP 3.25581
175 3JVH HHV 3.27869
176 6AIN FAD 3.34928
177 1KYQ NAD 3.58744
178 2VHW NAI 3.58744
179 2PV7 NAD 3.58744
180 2HK9 NAP 3.58744
181 1LDN NAD 3.58744
182 5HSA FAS 3.58744
183 3FPZ AHZ 3.58744
184 1REO FAD 3.58744
185 1EQ2 NAP 3.58744
186 3B20 NAD 3.58744
187 5OCM NAP 3.58744
188 3CTY FAD 3.58744
189 2AQJ FAD 3.58744
190 2AQJ TRP 3.58744
191 4FZV SAM 3.58744
192 2X6T NAP 3.58744
193 3B1J NAD 3.58744
194 4TXI FAD 3.58744
195 2CUL FAD 3.58744
196 4YJK URA 3.58744
197 5I39 FAD 3.58744
198 3G89 SAM 3.58744
199 1WP4 NDP 3.58744
200 5K53 STE 3.58744
201 4GOX A3P 3.58744
202 4CYI ATP 3.58744
203 2D2I NAP 3.58744
204 2CVZ NDP 3.58744
205 6GAS FAD 3.58744
206 3JSX FAD 3.58744
207 4L80 1VU 3.58744
208 3T1A 5MA 3.58744
209 5X2Z 3LM 3.58744
210 1YS4 NAP 3.58744
211 1RM4 NDP 3.58744
212 5A7Y SAH 3.58744
213 2VZZ SCA 3.66972
214 4Z28 BTN 3.73134
215 2HKA C3S 3.84615
216 4JJF N2I 4.03587
217 4JJF FE9 4.03587
218 3O9Z AKG 4.03587
219 6CEP NAD 4.03587
220 3O9Z NAD 4.03587
221 9LDB NAD 4.03587
222 2AG8 NAP 4.03587
223 5TS5 FAD 4.03587
224 1ZH8 NAP 4.03587
225 1HDG NAD 4.03587
226 5U19 SAH 4.03587
227 5U19 827 4.03587
228 3D91 REM 4.03587
229 4C3Y FAD 4.03587
230 4C3Y ANB 4.03587
231 1DIG L37 4.03587
232 1TLL NAP 4.03587
233 1JQ3 AAT 4.03587
234 1ZGA SAH 4.03587
235 9LDT NAD 4.03587
236 1DIG NAP 4.03587
237 4DE3 DN8 4.03587
238 4PIO SAH 4.03587
239 5KKA 6V0 4.03587
240 5KF9 ACO 4.03587
241 6FRN FMN 4.03587
242 1OPK MYR 4.03587
243 1B8U NAD 4.03587
244 4UBT 3G6 4.03587
245 3P2E SAH 4.03587
246 6AMI TRP 4.03587
247 2P3C 3TL 4.0404
248 5OWC AYZ 4.09836
249 1JQ9 PHE LEU SER TYR LYS 4.13223
250 6CE2 SVR 4.13223
251 1L3I SAH 4.16667
252 1DJL NAP 4.34783
253 5RHN 8BR 4.34783
254 3FSM 2NC 4.4335
255 1J0X NAD 4.4843
256 1RM0 D6P 4.4843
257 1RM0 NAI 4.4843
258 3QJ4 FAD 4.4843
259 5UR0 NAD 4.4843
260 1GAD NAD 4.4843
261 2YVF NAD 4.4843
262 4MOP 2H5 4.4843
263 1NV8 SAM 4.4843
264 1NV8 MEQ 4.4843
265 3CMC NAD 4.4843
266 5KVS 6XR 4.4843
267 4YCA NDP 4.4843
268 3WLE NAD 4.4843
269 5KVS NAP 4.4843
270 1K3T BRZ 4.4843
271 5EZ7 FAD 4.4843
272 1X87 NAD 4.4843
273 1H82 GZZ 4.4843
274 1VQW FAD 4.4843
275 1JG3 ADN 4.4843
276 2GV8 NDP 4.4843
277 4CNK FAD 4.4843
278 1F8G NAD 4.4843
279 3AB1 FAD 4.4843
280 3SSO SAH 4.4843
281 1H82 FAD 4.4843
282 2OOR NAD 4.4843
283 1QO8 FAD 4.4843
284 4UP3 FAD 4.4843
285 2ZAT NAP 4.4843
286 2FZW NAD 4.4843
287 6ECT SAM 4.4843
288 1L7E NAI 4.4843
289 3B2Q ATP 4.4843
290 4X7G NAP 4.4843
291 4RQU NAD 4.4843
292 1YBH FAD 4.4843
293 1F76 FMN 4.4843
294 5BNW 12V 4.4843
295 2GVC FAD 4.4843
296 4USI ATP 4.54545
297 2PXX SAH 4.65116
298 5JCM NAD 4.65632
299 5JCM ISD 4.65632
300 5JCM FAD 4.65632
301 1E6E FAD 4.6875
302 1XVB BHL 4.70588
303 4RI1 ACO 4.83871
304 1FFU FAD 4.90798
305 1OMO NAD 4.93274
306 1X7D ORN 4.93274
307 1X7D NAD 4.93274
308 3VPH OXM 4.93274
309 3VPH NAD 4.93274
310 3CIF NAD 4.93274
311 3CIF G3H 4.93274
312 4ZVV NAD 4.93274
313 4ZVV GN0 4.93274
314 2F5Z FAD 4.93274
315 5J5Z FAD 4.93274
316 5J7X FAD 4.93274
317 6BQ6 TER 4.93274
318 1A5Z NAD 4.93274
319 2DFV NAD 4.93274
320 3AYI HCI 4.93274
321 3AYI FAD 4.93274
322 3RNM FAD 4.93274
323 2RGO FAD 4.93274
324 1O6Z NAD 4.93274
325 2Q7V FAD 4.93274
326 4TM3 FAD 4.93274
327 5TC4 NAD 4.93274
328 4BVA NDP 4.93274
329 3ICS FAD 4.93274
330 3ICT FAD 4.93274
331 2GMH FAD 4.93274
332 3ICR FAD 4.93274
333 2RGH FAD 4.93274
334 3GRU AMP 4.93274
335 3VZS NAP 4.93274
336 4X9M FAD 4.93274
337 3ICS ADP 4.93274
338 3VZS CAA 4.93274
339 3ICT ADP 4.93274
340 1R6T TYM 4.93274
341 3WBF NAP 4.93274
342 5DP2 NAP 4.93274
343 5DH3 5BS 4.93274
344 3WBF API 4.93274
345 5K52 OCD 4.93274
346 1R6U TYM 4.93274
347 5ZW3 SAH 4.93274
348 5TUK FAD 4.93274
349 1JJE BYS 4.95496
350 1NNU TCT 5
351 1NNU NAD 5
352 4K30 NLG 5
353 1P1C SAH 5.02513
354 2J9D AMP 5.04202
355 2J9D ADP 5.04202
356 2J9C ATP 5.04202
357 1IDA 0PO 5.05051
358 4EKQ NPO 5.34759
359 4XQC NAD 5.38117
360 4XQC 13D 5.38117
361 4MP8 MLI 5.38117
362 4MP8 NAD 5.38117
363 1LLU NAD 5.38117
364 4M52 M52 5.38117
365 4M52 FAD 5.38117
366 1HYH NAD 5.38117
367 5YU3 PRO 5.38117
368 5YU3 NAD 5.38117
369 2A8X FAD 5.38117
370 2NVK FAD 5.38117
371 4D79 ATP 5.38117
372 5TTJ FAD 5.38117
373 4D42 NAP 5.38117
374 4D42 W0I 5.38117
375 2PD4 DCN 5.38117
376 2PD4 NAD 5.38117
377 1Q9I TEO 5.38117
378 1Q9I FAD 5.38117
379 1JNR FAD 5.38117
380 5EES NAP 5.38117
381 5O9F NAD 5.38117
382 5O9F 9ON 5.38117
383 5N0J FAD 5.38117
384 3VHE 42Q 5.38117
385 4ZY1 4U5 5.38117
386 5BVE 4VG 5.38117
387 5ZI2 ADP 5.38117
388 5ZBC FAD 5.38117
389 1QD1 FON 5.38117
390 5TV6 PML 5.38117
391 3A28 NAD 5.38117
392 5ZI2 NAD 5.38117
393 3H5N ATP 5.38117
394 5TDF 7A3 5.38117
395 4RC8 STE 5.40541
396 3HVJ 705 5.42986
397 1N71 COA 5.55556
398 1Y8Q ATP 5.8296
399 4YT4 FE9 5.8296
400 1V59 FAD 5.8296
401 4E13 NAD 5.8296
402 1SOW NAD 5.8296
403 5U8U FAD 5.8296
404 5G3U FDA 5.8296
405 4NTD FAD 5.8296
406 5JY6 NAD 5.8296
407 4RDI ATP 5.8296
408 4RDH AMP 5.8296
409 1QG6 NAD 5.8296
410 1QG6 TCL 5.8296
411 3UOY NAP 5.8296
412 3UOY FAD 5.8296
413 2WET FAD 5.8296
414 2YG3 FAD 5.8296
415 1R37 NAD 5.8296
416 5EB4 FAD 5.8296
417 5G3U ITW 5.8296
418 5EOW FAD 5.8296
419 3ITJ FAD 5.8296
420 1VJT NAD 5.8296
421 1V59 NAD 5.8296
422 3HUJ AGH 5.8296
423 1E3I CXF 5.8296
424 6DNT NAD 5.8296
425 1SAY PYR 5.8296
426 5OSW AE4 5.8296
427 3JUQ AJD 5.94595
428 3JUQ AKD 5.94595
429 5KWY C3S 6.01504
430 3MWS 017 6.06061
431 1SIV PSI 6.06061
432 2D5A COA 6.25
433 3HAD NAD 6.27803
434 3QFA FAD 6.27803
435 5LD5 NAD 6.27803
436 1OBB NAD 6.27803
437 2I7C AAT 6.27803
438 6CZ7 MGD 6.27803
439 4YRY FAD 6.27803
440 4YRY NAD 6.27803
441 5AYV KPL 6.27803
442 4YNU FAD 6.27803
443 6FP4 FAD 6.27803
444 6FP4 E1T 6.27803
445 3GD4 FAD 6.27803
446 3GD4 NAD 6.27803
447 6H3O FAD 6.27803
448 4KRI SAH 6.27803
449 1YKJ FAD 6.27803
450 5U5G NAP 6.27803
451 5AYV NAP 6.27803
452 1ZEM NAD 6.27803
453 3NKS FAD 6.27803
454 3DMH GMP 6.27803
455 1S4M LUM 6.27803
456 2YVJ NAI 6.42202
457 6C4N NAP 6.72646
458 1MV8 NAD 6.72646
459 1MUU NAD 6.72646
460 2JHP SAH 6.72646
461 3OJO NAD 6.72646
462 5BW4 SAM 6.72646
463 1C0I BE2 6.72646
464 1C0I FAD 6.72646
465 4USQ FAD 6.72646
466 1HDR NAD 6.72646
467 4W6Z 8ID 6.72646
468 1Q1R FAD 6.72646
469 6GWR FEW 6.72646
470 4L1F FAD 6.72646
471 1DL5 SAH 6.72646
472 5OVK NDP 6.72646
473 4CJX NAP 6.72646
474 2EWM NAD 6.72646
475 1NYT NAP 6.72646
476 4POO SAM 7
477 3Q9N COA 7.0922
478 5Y8L HUI 7.17489
479 5Y8L NAD 7.17489
480 6A3J SOE 7.17489
481 6A3J NAI 7.17489
482 6ER9 NAP 7.17489
483 2CDC XYS 7.17489
484 2F1K NAP 7.17489
485 2CDC NAP 7.17489
486 5T67 JHZ 7.17489
487 2CDC XYP 7.17489
488 1CER NAD 7.17489
489 5T67 SAH 7.17489
490 2HJR APR 7.17489
491 3X0V FAD 7.17489
492 3ZNN 4WL 7.17489
493 3ZNN FAD 7.17489
494 3CGB FAD 7.17489
495 1CF2 NAP 7.17489
496 5NUF NAD 7.17489
497 5NUE NAD 7.17489
498 3CGD FAD 7.17489
499 1PZG A3D 7.17489
500 5GSN FAD 7.17489
501 5GSN NAP 7.17489
502 3CGD NAD 7.17489
503 3CGD COA 7.17489
504 2BRY FAD 7.17489
505 1COY FAD 7.17489
506 1D1T NAD 7.17489
507 5E4R NAP 7.17489
508 5BV3 M7G 7.17489
509 1YAG ATP 7.2
510 5EXE 5SR 7.30159
511 1HDC CBO 7.48031
512 4JK3 NAD 7.62332
513 5YAP 8S0 7.62332
514 4J4H 1J1 7.62332
515 4J4H NAI 7.62332
516 5YAP NAI 7.62332
517 3B1F NAD 7.62332
518 5YB7 ORN 7.62332
519 5YB7 FAD 7.62332
520 2Q1S NAI 7.62332
521 5NII FAD 7.62332
522 1VI2 NAD 7.62332
523 1RP0 AHZ 7.62332
524 1NPD NAD 7.62332
525 1GTE FAD 7.62332
526 4MDH NAD 7.62332
527 1PS9 NAP 7.62332
528 3TKY SAH 7.62332
529 2QA1 FAD 7.62332
530 1PS9 FAD 7.62332
531 5YJF 8WO 7.62332
532 5YJF SAH 7.62332
533 2QTZ NAP 7.62332
534 4R84 CSF 7.62332
535 5H5F SAM 7.62332
536 5G09 6DF 7.62332
537 2IYG FMN 8.06452
538 1DSS NAD 8.07175
539 1WDK NAD 8.07175
540 4FWE FAD 8.07175
541 1DJN ADP 8.07175
542 1O94 ADP 8.07175
543 4HSU FAD 8.07175
544 5J60 FAD 8.07175
545 4GUT FAD 8.07175
546 1NVM NAD 8.07175
547 6EL3 NAP 8.07175
548 2AHR NAP 8.07175
549 4EIP FAD 8.07175
550 2ZJ1 ARJ 8.07175
551 2ZJ1 NAD 8.07175
552 3FWN ATR 8.07175
553 4XDY NAI 8.07175
554 3IHG FAD 8.07175
555 1LVW TYD 8.07175
556 3L9W AMP 8.07175
557 3L9W GSH 8.07175
558 1O94 AMP 8.07175
559 5ZZ6 ADP 8.17308
560 5ZZ6 NAD 8.17308
561 1S8G DAO 8.26446
562 3NCQ ATP 8.40336
563 2Z9C DTC 8.5
564 1J5P NAD 8.52018
565 5CAE COA 8.52018
566 5CAE SIN 8.52018
567 4OM8 NAD 8.52018
568 2VYN NAD 8.52018
569 5NMX NAP 8.52018
570 4JNA FAD 8.52018
571 2R4J 13P 8.52018
572 2R4J FAD 8.52018
573 3FUU ADN 8.52018
574 5NMX FAD 8.52018
575 6GNC FAD 8.52018
576 1ELI PYC 8.52018
577 4EDF UPG 8.52018
578 5K0A FAD 8.52018
579 2OYS FMN 8.67769
580 2VPY MGD 8.69565
581 4J56 FAD 8.77193
582 3DZ6 M8E 8.95522
583 1I7M CG 8.95522
584 1EZ4 NAD 8.96861
585 6F3N NAD 8.96861
586 6F3N ADN 8.96861
587 6F3M NAD 8.96861
588 3H9E NAD 8.96861
589 1GV0 NAD 8.96861
590 1YY5 FAD 8.96861
591 3VYW SAM 8.96861
592 5Z2F NAP 8.96861
593 2B3D FAD 8.96861
594 3L4S 3PG 8.96861
595 3L4S NAD 8.96861
596 4IV9 FAD 8.96861
597 2ART LPA AMP 8.96861
598 2YYY NAP 8.96861
599 1GUZ NAD 8.96861
600 3RLF MAL 8.96861
601 4YV5 SVR 9.01639
602 5O3Q CMP 9.16667
603 5W10 CMP 9.23077
604 3NJ4 NAD 9.41704
605 4Z0H NAD 9.41704
606 1I9G SAM 9.41704
607 1XHC FAD 9.41704
608 4RSL FAD 9.41704
609 2WYV NAD 9.41704
610 4B4U NAP 9.41704
611 5VN0 FAD 9.41704
612 5FJN BE2 9.41704
613 5FJN FAD 9.41704
614 3NJ4 AFX 9.41704
615 5Y77 FAD 9.41704
616 2XIQ MLC 9.41704
617 3WYJ H78 9.41704
618 1H7F C5P 9.41704
619 2CVQ NDP 9.41704
620 2DT5 NAD 9.47867
621 4R3U 3HC 9.49367
622 4R3U 3KK 9.49367
623 3DXY SAM 9.63303
624 4II2 ATP 9.86547
625 3V1Y NAD 9.86547
626 1VM6 NAD 9.86547
627 3NDJ SAH 9.86547
628 3NDJ JHZ 9.86547
629 3A4V PYR 9.86547
630 3A4V NAD 9.86547
631 2VBQ BSJ 10.303
632 2ZXI FAD 10.3139
633 1RP7 TZD 10.3139
634 2HQM FAD 10.3139
635 3LXK MI1 10.3139
636 5ODQ FAD 10.3261
637 2HMT NAI 10.4167
638 2RIF AMP 10.6383
639 1LSS NAD 10.7143
640 2Z3Y F2N 10.7623
641 4AP3 FAD 10.7623
642 4AP3 NAP 10.7623
643 3N1S 5GP 10.9244
644 4Z24 FAD 11.2108
645 2NU8 COA 11.6592
646 2CDU FAD 11.6592
647 2CDU ADP 11.6592
648 2E5V FAD 11.6592
649 5TCI 79V 11.6592
650 3CF6 SP1 11.976
651 1ZK7 FAD 12.1076
652 1BZL FAD 12.1076
653 6GQM F8H 12.1076
654 5BUK FAD 12.1076
655 1O0S NAI 12.1076
656 2EV9 SKM 12.1673
657 2EV9 NAP 12.1673
658 5Y1G AKB 12.5561
659 4GKV NAD 12.7976
660 1NM5 NAD 12.8079
661 3DAG FEG 13.0045
662 1ZQ9 SAM 13.0045
663 2RAB NAD 13.0045
664 2RAB FAD 13.0045
665 2PWY SAH 13.0045
666 1U1I NAD 13.0045
667 3H8V ATP 13.4529
668 5L95 AMP 13.4529
669 4XB2 NDP 13.4529
670 4XB2 HSE 13.4529
671 5WP4 SAH 13.4529
672 5Y6Q FAD 13.5802
673 5JE8 NAD 13.9013
674 2WPF FAD 13.9013
675 4RVG SAM 13.9013
676 4RVG TYD 13.9013
677 3LF0 ATP 14.0351
678 4XYM COA 14.3498
679 4XZ3 COA 14.3498
680 3HRD FAD 14.375
681 3OND NAD 14.7982
682 3OND ADN 14.7982
683 2E7Z MGD 14.7982
684 5TVF CGQ 14.7982
685 5M67 NAD 15.2466
686 5M67 ADE 15.2466
687 5YEC ATP 15.2466
688 5I7S E9P 15.2466
689 5I7S NAD 15.2466
690 4D04 NAP 15.2466
691 4D04 FAD 15.2466
692 5M67 3D1 15.2466
693 4B7X NAP 15.2466
694 2PT9 S4M 15.2648
695 3QV1 NAD 15.8537
696 1V8B NAD 16.1435
697 3TWO NDP 16.1435
698 1JQD SAH 16.5919
699 1JQD HSM 16.5919
700 5TOW ADN 17.0404
701 5TOW NAI 17.0404
702 4IX4 ADP 17.0404
703 3NRZ FAD 18.3857
704 2DKH FAD 18.3857
705 2DKH 3HB 18.3857
706 2DC1 NAD 18.8341
707 2G5C NAD 19.2825
708 3GGO NAI 19.7309
709 3GGO ENO 19.7309
710 3AD8 NAD 20.202
711 5UAV TFB 20.6278
712 5UAV NDP 20.6278
713 4NSQ COA 21.0526
714 2GAG NAD 21.2121
715 2AOT SAH 21.5247
716 2B4R NAD 22.4215
717 2B4R AES 22.4215
718 3ORF NAD 22.87
719 4L8V NAP 22.87
720 1H5S TMP 23.3184
721 1H5R THM 23.3184
722 1BW9 NAD 25.1121
723 1C1X NAD 25.1121
724 1BXG NAD 25.1121
725 1BXG HCI 25.1121
726 1C1D PHE 25.1121
727 2O4C NAD 30.0448
728 2XN5 FUN 31.4286
729 4XYB NDP 41.704
730 2GSD NAD 42.6009
731 2NAD NAD 43.0493
732 5DN9 NAD 43.9462
733 1J49 NAD 46.1883
734 5Z20 NAI 47.5336
735 4ZGS NAD 47.9821
736 3KB6 NAD 49.3274
737 5Z21 NAI 49.7758
Pocket No.: 2; Query (leader) PDB : 5OFW; Ligand: 9TW; Similar sites found with APoc: 164
This union binding pocket(no: 2) in the query (biounit: 5ofw.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 1T26 GBD None
2 1T26 NAI None
3 4X6I 3Y1 None
4 4NBU NAI None
5 4BX7 B4F None
6 4IEN GDP None
7 4M73 M72 0.896861
8 4M73 SAH 0.896861
9 2WPU KYT 1.25786
10 4MSG 2C6 1.38249
11 1LVL FAD 1.79372
12 4C0X AQN 1.97044
13 1S17 GNR 2.22222
14 3HDY FAD 2.24215
15 3HDY GDU 2.24215
16 1MXH DHF 2.24215
17 1MXH NAP 2.24215
18 5T8O 76Z 2.24215
19 3PP0 03Q 2.24215
20 3NGL NAP 2.24215
21 2IVD FAD 2.69058
22 2VNI FAD 2.69058
23 2VNI A2P 2.69058
24 5EOU ATP 2.69058
25 3NTA FAD 3.13901
26 1E1M NAP 3.13901
27 1E1M FAD 3.13901
28 5UR1 YY9 3.13901
29 5FM0 WAQ 3.13901
30 6ECU SAH 3.13901
31 5W4W 9WG 3.13901
32 1MJT ITU 3.13901
33 3HBN UDP 3.13901
34 2AKO ADP 3.13901
35 2IVF MD1 3.27103
36 1U3U NAD 3.58744
37 1U3U BNF 3.58744
38 4D7E FAD 3.58744
39 2V0C ANZ 3.58744
40 3GMB FAD 3.58744
41 1Z45 UPG 3.58744
42 1UAY ADN 3.71901
43 5G3N X28 3.93701
44 5MIT FAD 4.03587
45 5MIT NAP 4.03587
46 1B8U OAA 4.03587
47 4PIO AVI 4.03587
48 3H4V NAP 4.03587
49 6F9Q NAD 4.03587
50 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 4.03587
51 3KA2 2NC 4.4335
52 3KLJ FAD 4.4843
53 3O03 NAP 4.4843
54 3SJ7 NDP 4.4843
55 3S5W FAD 4.4843
56 5M58 SAH 4.4843
57 1QMG APX 4.4843
58 2XNJ NAP 4.4843
59 1YQZ FAD 4.93274
60 3AXB FAD 4.93274
61 3AXB PRO 4.93274
62 3GDN FAD 4.93274
63 1XTP SAI 4.93274
64 5VW2 NAP 4.93274
65 5VW2 FDA 4.93274
66 1O97 FAD 4.93274
67 1O97 AMP 4.93274
68 3NC9 TR3 4.93274
69 5T9F NAP 4.93274
70 5T9F TYR 4.93274
71 5E9W SAH 4.93274
72 1FND A2P 5.09554
73 1FND FAD 5.09554
74 3WSJ MK1 5.17241
75 1T57 FMN 5.33981
76 3LAD FAD 5.38117
77 2Q0L FAD 5.38117
78 1LDM NAD 5.38117
79 2C7G FAD 5.38117
80 2C7G ODP 5.38117
81 3LZW NAP 5.38117
82 3LZW FAD 5.38117
83 4Z5W TYS ILE TYS THR GLN 5.38117
84 6FDF SAH 5.38117
85 1GPE FAD 5.38117
86 1NAA 6FA 5.38117
87 3ETG GTP 5.38117
88 6MPT C30 5.38117
89 5U6C 7YS 5.38117
90 3ETG NDP 5.38117
91 3ETG GLU 5.38117
92 1CDO NAD 5.38117
93 2P9H IPT 5.38117
94 1N2X SAM 5.38117
95 3O9L LPN 5.42169
96 3QUZ QUV 5.74163
97 2IID FAD 5.8296
98 2IID PHE 5.8296
99 4B63 NAP 5.8296
100 4B63 FAD 5.8296
101 4B63 ORN 5.8296
102 4KOA NDP 5.8296
103 3LXD FAD 5.8296
104 5DLY SAH 5.8296
105 5DLY 5D7 5.8296
106 5OC1 FAD 5.8296
107 3JQQ A2P 5.8296
108 4CS4 ANP 5.8296
109 4YNU LGC 6.27803
110 5MQ6 NDP 6.27803
111 4J75 TYM 6.27803
112 2Q4W FAD 6.27803
113 3FHI ANP 6.27803
114 4P6X HCY 6.27803
115 1VKO NAD 6.72646
116 5ZYN FAD 6.72646
117 1Z0S ATP 6.72646
118 2WEI VGG 6.72646
119 3O7U O7U 6.72646
120 3CIP ATP 7.03125
121 3UCL CYH 7.17489
122 3UCL FAD 7.17489
123 3UCL NAP 7.17489
124 6ER9 FAD 7.17489
125 1COY AND 7.17489
126 4XDZ NDP 7.17489
127 3X0D SAH 7.17489
128 4ITH RCM 7.17489
129 1WKR IVA VAL VAL STA ALA STA 7.17489
130 2IZ1 ATR 7.17489
131 1RM6 FAD 7.45342
132 5MDH NAD 7.62332
133 1G0N NDP 7.62332
134 1G0N PHH 7.62332
135 4GUS FAD 8.07175
136 4REP FAD 8.07175
137 5UKL SIX 8.07175
138 1EJ0 SAM 8.33333
139 6GAR FAD 8.52018
140 2BGM NAJ 8.52018
141 3BEO UDP 8.52018
142 2NXE SAM 8.52018
143 1RC0 KT5 8.61244
144 2V6G NAP 8.96861
145 5JE0 SAH 8.96861
146 5JE0 AZ8 8.96861
147 1VG0 GER 9.17874
148 5VN0 NAI 9.41704
149 1T3Q FAD 9.41704
150 4ZOH FAD 9.41704
151 4YSX FAD 9.61539
152 4AU8 Z3R 9.86547
153 5Z75 NAD 10.7623
154 4OHU NAD 10.7623
155 4OHU 2TK 10.7623
156 3F6R FMN 10.8108
157 1PN0 FAD 11.2108
158 5JCA FAD 11.6592
159 1BZL GCG 12.1076
160 2WPF WPF 13.9013
161 1N62 FAD 14.3498
162 4AIG FLX 14.9254
163 2PT9 2MH 15.2648
164 3WR7 COA 17.0588
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