Receptor
PDB id Resolution Class Description Source Keywords
2HDK 2.4 Å EC: 2.6.1.42 CRYSTAL STRUCTURE OF CYS315ALA-CYS318ALA MUTANT OF HUMAN MIT BRANCHED CHAIN AMINOTRANSFERASE HOMO SAPIENS D-AMINOACID AMINOTRANSFERASE-LIKE PLP-DEPENDENT ENZYMES TRA
Ref.: HUMAN MITOCHONDRIAL BRANCHED CHAIN AMINOTRANSFERASE STRUCTURAL ROLE OF THE CXXC CENTER IN CATALYSIS. J.BIOL.CHEM. V. 281 39660 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACY A:1001;
Invalid;
none;
submit data
60.052 C2 H4 O2 CC(=O...
COI B:900;
Valid;
none;
Kd = 6.1 mM
130.142 C6 H10 O3 CC(C)...
PLP A:400;
B:401;
Invalid;
Invalid;
none;
none;
submit data
247.142 C8 H10 N O6 P Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5I60 2.12 Å EC: 2.6.1.42 X-RAY CRYSTAL STRUCTURE AT 2.12A RESOLUTION OF HUMAN MITOCHO BRANCHED CHAIN AMINOTRANSFERASE (BCATM) COMPLEXED WITH A BIC OMPOUND AND AN INTERNAL ALDIMINE LINKED PLP COFACTOR. HOMO SAPIENS FOLD TYPE IV TRANSFERASE
Ref.: STRUCTURALLY DIVERSE MITOCHONDRIAL BRANCHED CHAIN AMINOTRANSFERASE (BCATM) LEADS WITH VARYING BINDING IDENTIFIED BY FRAGMENT SCREENING. J.MED.CHEM. V. 59 2452 2016
Members (21)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 5CR5 ic50 = 2 uM EL1 C24 H24 Br N3 O5 S2 CNC(=O)c1c....
2 1KT8 - ILP C14 H23 N2 O7 P CC[C@H](C)....
3 5BWR ic50 = 25 uM 4VT C14 H10 N4 O c1ccc(cc1)....
4 5I5W ic50 = 1 mM 68B C11 H9 N3 O c1ccc(cc1)....
5 5I5S - NVU C9 H7 N O3 c1ccc2c(c1....
6 5BWW ic50 = 0.5 uM 4W6 C16 H19 N5 O2 CCCC1=CC(=....
7 5I5U - 67Y C12 H15 N O2 c1ccc2c(c1....
8 5I5Y ic50 = 1 uM 68D C16 H13 N3 O4 S Cc1c2c(sc1....
9 5I60 ic50 = 0.00000001 M 67W C18 H15 N3 O3 c1ccc(c(c1....
10 5BWX ic50 = 16 nM 4W4 C18 H17 Cl F N5 O CCCCC1=CC(....
11 5I5V ic50 = 63 uM 68A C9 H8 N2 O3 S Cc1c2c(sc1....
12 5BWV ic50 = 79 nM 775 C17 H16 Cl N5 O CCCC1=CC(=....
13 5HNE ic50 = 50 nM EL2 C25 H24 Br N5 O2 S CNC(=O)c1c....
14 5BWU ic50 = 0.63 uM 4VR C15 H16 Br N5 O CCCC1=CC(=....
15 2HDK Kd = 6.1 mM COI C6 H10 O3 CC(C)CC(=O....
16 2A1H Ki = 65.4 mM GBN C9 H17 N O2 C1CCC(CC1)....
17 5I5T - 67X C10 H14 N2 O2 S C[C@@H]1Cc....
18 5I5X ic50 = 0.2 uM 68C C10 H7 N5 O2 S2 Cc1c2c(sc1....
19 2HG8 - MLE C7 H15 N O2 CC(C)C[C@@....
20 1KTA - KIV C5 H8 O3 CC(C)C(=O)....
21 5BWT - 4VS C10 H10 N4 O CCC1=CC(=O....
70% Homology Family (25)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 5CR5 ic50 = 2 uM EL1 C24 H24 Br N3 O5 S2 CNC(=O)c1c....
2 1KT8 - ILP C14 H23 N2 O7 P CC[C@H](C)....
3 5BWR ic50 = 25 uM 4VT C14 H10 N4 O c1ccc(cc1)....
4 5I5W ic50 = 1 mM 68B C11 H9 N3 O c1ccc(cc1)....
5 5I5S - NVU C9 H7 N O3 c1ccc2c(c1....
6 5BWW ic50 = 0.5 uM 4W6 C16 H19 N5 O2 CCCC1=CC(=....
7 5I5U - 67Y C12 H15 N O2 c1ccc2c(c1....
8 5I5Y ic50 = 1 uM 68D C16 H13 N3 O4 S Cc1c2c(sc1....
9 5I60 ic50 = 0.00000001 M 67W C18 H15 N3 O3 c1ccc(c(c1....
10 5BWX ic50 = 16 nM 4W4 C18 H17 Cl F N5 O CCCCC1=CC(....
11 5I5V ic50 = 63 uM 68A C9 H8 N2 O3 S Cc1c2c(sc1....
12 5BWV ic50 = 79 nM 775 C17 H16 Cl N5 O CCCC1=CC(=....
13 5HNE ic50 = 50 nM EL2 C25 H24 Br N5 O2 S CNC(=O)c1c....
14 5BWU ic50 = 0.63 uM 4VR C15 H16 Br N5 O CCCC1=CC(=....
15 2HDK Kd = 6.1 mM COI C6 H10 O3 CC(C)CC(=O....
16 2A1H Ki = 65.4 mM GBN C9 H17 N O2 C1CCC(CC1)....
17 5I5T - 67X C10 H14 N2 O2 S C[C@@H]1Cc....
18 5I5X ic50 = 0.2 uM 68C C10 H7 N5 O2 S2 Cc1c2c(sc1....
19 2HG8 - MLE C7 H15 N O2 CC(C)C[C@@....
20 1KTA - KIV C5 H8 O3 CC(C)C(=O)....
21 5BWT - 4VS C10 H10 N4 O CCC1=CC(=O....
22 2COI Ki = 3.5 mM GBN C9 H17 N O2 C1CCC(CC1)....
23 2COJ Ki = 1.3 mM GBN C9 H17 N O2 C1CCC(CC1)....
24 2COG - 4MV C6 H12 O2 CC(C)CCC(=....
25 2ABJ ic50 = 0.8 uM CBC C16 H10 Cl F3 N2 O4 S c1ccc(c(c1....
50% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 5CR5 ic50 = 2 uM EL1 C24 H24 Br N3 O5 S2 CNC(=O)c1c....
2 1KT8 - ILP C14 H23 N2 O7 P CC[C@H](C)....
3 5BWR ic50 = 25 uM 4VT C14 H10 N4 O c1ccc(cc1)....
4 5I5W ic50 = 1 mM 68B C11 H9 N3 O c1ccc(cc1)....
5 5I5S - NVU C9 H7 N O3 c1ccc2c(c1....
6 5BWW ic50 = 0.5 uM 4W6 C16 H19 N5 O2 CCCC1=CC(=....
7 5I5U - 67Y C12 H15 N O2 c1ccc2c(c1....
8 5I5Y ic50 = 1 uM 68D C16 H13 N3 O4 S Cc1c2c(sc1....
9 5I60 ic50 = 0.00000001 M 67W C18 H15 N3 O3 c1ccc(c(c1....
10 5BWX ic50 = 16 nM 4W4 C18 H17 Cl F N5 O CCCCC1=CC(....
11 5I5V ic50 = 63 uM 68A C9 H8 N2 O3 S Cc1c2c(sc1....
12 5BWV ic50 = 79 nM 775 C17 H16 Cl N5 O CCCC1=CC(=....
13 5HNE ic50 = 50 nM EL2 C25 H24 Br N5 O2 S CNC(=O)c1c....
14 5BWU ic50 = 0.63 uM 4VR C15 H16 Br N5 O CCCC1=CC(=....
15 2HDK Kd = 6.1 mM COI C6 H10 O3 CC(C)CC(=O....
16 2A1H Ki = 65.4 mM GBN C9 H17 N O2 C1CCC(CC1)....
17 5I5T - 67X C10 H14 N2 O2 S C[C@@H]1Cc....
18 5I5X ic50 = 0.2 uM 68C C10 H7 N5 O2 S2 Cc1c2c(sc1....
19 2HG8 - MLE C7 H15 N O2 CC(C)C[C@@....
20 1KTA - KIV C5 H8 O3 CC(C)C(=O)....
21 5BWT - 4VS C10 H10 N4 O CCC1=CC(=O....
22 2COI Ki = 3.5 mM GBN C9 H17 N O2 C1CCC(CC1)....
23 2COJ Ki = 1.3 mM GBN C9 H17 N O2 C1CCC(CC1)....
24 2COG - 4MV C6 H12 O2 CC(C)CCC(=....
25 2ABJ ic50 = 0.8 uM CBC C16 H10 Cl F3 N2 O4 S c1ccc(c(c1....
26 3UZO - PLP C8 H10 N O6 P Cc1c(c(c(c....
27 3UYY - PLP C8 H10 N O6 P Cc1c(c(c(c....
28 3HT5 - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
29 5U3F - 7TS C11 H14 N3 O7 P Cc1c(c(c(c....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: COI; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 COI 1 1
2 IVA 0.571429 0.631579
3 2KT 0.454545 0.736842
4 69O 0.4 0.714286
Similar Ligands (3D)
Ligand no: 1; Ligand: COI; Similar ligands found: 856
No: Ligand Similarity coefficient
1 OAA 0.9939
2 LEU 0.9920
3 LMR 0.9919
4 ASP 0.9917
5 CRN 0.9888
6 IOM 0.9862
7 ASN 0.9859
8 MLT 0.9848
9 2RH 0.9768
10 UGC 0.9764
11 DAS 0.9757
12 SIN 0.9756
13 40E 0.9749
14 ITN 0.9697
15 FUM 0.9681
16 HIO 0.9663
17 IZC 0.9649
18 SRT 0.9645
19 DYA 0.9612
20 PEP 0.9605
21 BEZ 0.9598
22 CFI 0.9590
23 TLA 0.9574
24 AL0 0.9567
25 BEN 0.9567
26 R67 0.9566
27 9X7 0.9563
28 JYD 0.9557
29 HL5 0.9550
30 ISZ 0.9549
31 BAM 0.9544
32 BNS 0.9542
33 HSE 0.9541
34 6PC 0.9536
35 NIZ 0.9534
36 GUA 0.9528
37 PBC 0.9526
38 SPV 0.9522
39 NCA 0.9522
40 HX2 0.9521
41 NIO 0.9518
42 NVA 0.9518
43 NTN 0.9511
44 BHO 0.9507
45 SKG 0.9502
46 SS2 0.9502
47 PAC 0.9500
48 DCL 0.9495
49 TEO 0.9494
50 PZI 0.9494
51 QY9 0.9493
52 CIZ 0.9490
53 2CO 0.9484
54 GLN 0.9483
55 FEH 0.9483
56 DAB 0.9480
57 3SL 0.9479
58 PZA 0.9474
59 MLE 0.9473
60 AKG 0.9459
61 ORN 0.9459
62 4MV 0.9457
63 PEQ 0.9456
64 0V5 0.9456
65 URQ 0.9451
66 UNU 0.9451
67 0VT 0.9450
68 IHG 0.9449
69 PHB 0.9448
70 NPO 0.9446
71 HSM 0.9437
72 3HB 0.9432
73 NBZ 0.9432
74 TFB 0.9429
75 PCA 0.9428
76 HDA 0.9425
77 QSC 0.9424
78 PMB 0.9419
79 PRO 0.9418
80 ILE 0.9417
81 PPR 0.9416
82 GLU 0.9414
83 PAB 0.9414
84 RSO 0.9409
85 GZ3 0.9408
86 VGL 0.9407
87 M58 0.9405
88 NMG 0.9399
89 SS1 0.9396
90 H95 0.9396
91 AC6 0.9394
92 GAB 0.9394
93 JBN 0.9392
94 7N0 0.9391
95 PGA 0.9389
96 THE 0.9389
97 HCS 0.9386
98 VKC 0.9385
99 SPA 0.9378
100 3NT 0.9378
101 OVV 0.9377
102 1Y6 0.9376
103 9YL 0.9376
104 TZC 0.9373
105 MRZ 0.9372
106 HZP 0.9371
107 MAE 0.9369
108 TAR 0.9369
109 DGN 0.9369
110 K34 0.9368
111 51F 0.9365
112 TZE 0.9363
113 M4T 0.9362
114 PBZ 0.9360
115 LNO 0.9356
116 FAN 0.9354
117 98J 0.9353
118 GLY GLY 0.9348
119 JZ7 0.9347
120 4MA 0.9346
121 NXA 0.9344
122 P72 0.9343
123 INO 0.9342
124 TZL 0.9341
125 ZBT 0.9341
126 FB2 0.9339
127 OK7 0.9336
128 1DQ 0.9333
129 NLE 0.9332
130 2PC 0.9331
131 PHU 0.9331
132 2HG 0.9328
133 AHB 0.9328
134 PLU 0.9327
135 14J 0.9326
136 4CS 0.9321
137 53C 0.9320
138 KIV 0.9319
139 YCP 0.9318
140 TP5 0.9316
141 GGL 0.9312
142 2IT 0.9312
143 1DU 0.9312
144 NYL 0.9309
145 VAH 0.9306
146 MET 0.9305
147 4NC 0.9305
148 DQY 0.9301
149 271 0.9301
150 PG3 0.9300
151 SC2 0.9300
152 GG6 0.9299
153 4P5 0.9299
154 CMS 0.9297
155 3BZ 0.9292
156 X1S 0.9291
157 HBA 0.9291
158 DGL 0.9287
159 KMH 0.9287
160 DHB 0.9287
161 XRG 0.9287
162 CXF 0.9285
163 HY3 0.9282
164 FQI 0.9281
165 HY1 0.9279
166 2HO 0.9279
167 MYJ 0.9278
168 ABU 0.9276
169 URP 0.9275
170 SHF 0.9275
171 KMT 0.9274
172 OEG 0.9272
173 268 0.9271
174 OEM 0.9271
175 HBD 0.9268
176 RNT 0.9268
177 7A8 0.9268
178 BE2 0.9261
179 ONL 0.9258
180 UY7 0.9258
181 URS 0.9256
182 FOA 0.9252
183 OGA 0.9251
184 SAL 0.9250
185 CSS 0.9249
186 MAK 0.9249
187 5OB 0.9247
188 MUC 0.9246
189 13P 0.9246
190 EDG 0.9242
191 Z82 0.9241
192 I4B 0.9238
193 5AC 0.9238
194 6JN 0.9236
195 MED 0.9235
196 XUL 0.9233
197 93K 0.9230
198 JZ5 0.9230
199 IT2 0.9223
200 OKG 0.9222
201 2AS 0.9217
202 MEV 0.9217
203 ACH 0.9216
204 MRY 0.9215
205 P9P 0.9210
206 BZ3 0.9210
207 THR 0.9209
208 RNS 0.9207
209 PEL 0.9205
210 7WG 0.9205
211 3AB 0.9205
212 FW5 0.9203
213 ALO 0.9199
214 PEA 0.9198
215 ROR 0.9197
216 HIS 0.9196
217 5FX 0.9194
218 SNE 0.9192
219 ES6 0.9191
220 PYC 0.9191
221 GJZ 0.9190
222 MZW 0.9190
223 1KA 0.9188
224 VAL 0.9187
225 4VP 0.9187
226 AC0 0.9181
227 1SA 0.9180
228 1AB 0.9180
229 C21 0.9179
230 HYP 0.9179
231 3PP 0.9178
232 PAF 0.9178
233 BP9 0.9177
234 3V4 0.9174
235 1DV 0.9173
236 S0H 0.9172
237 MXN 0.9172
238 PRS 0.9172
239 258 0.9170
240 ZGL 0.9170
241 BZX 0.9169
242 JKE 0.9168
243 3HG 0.9167
244 GLY ALA 0.9167
245 273 0.9167
246 SSN 0.9163
247 XCZ 0.9157
248 HYA 0.9155
249 RBL 0.9154
250 R2B 0.9153
251 449 0.9151
252 RB5 0.9149
253 XYL 0.9149
254 RB0 0.9149
255 IHB 0.9149
256 FBV 0.9148
257 ICF 0.9148
258 FB1 0.9147
259 ABN 0.9145
260 49F 0.9145
261 FBW 0.9144
262 1P3 0.9143
263 IP8 0.9143
264 APY 0.9143
265 PYJ 0.9142
266 DAV 0.9141
267 CHB 0.9141
268 9TY 0.9140
269 HTX 0.9140
270 XBT 0.9139
271 NBE 0.9137
272 3QM 0.9137
273 2PG 0.9135
274 6NA 0.9135
275 PAE 0.9134
276 AKB 0.9134
277 AHR 0.9133
278 N4B 0.9129
279 2LP 0.9128
280 FP1 0.9127
281 8GC 0.9126
282 TPA 0.9126
283 S2G 0.9126
284 XLS 0.9124
285 CP 0.9120
286 LER 0.9119
287 7C3 0.9118
288 JLZ 0.9118
289 4WL 0.9117
290 QDK 0.9117
291 SYN 0.9114
292 OTR 0.9112
293 4ZA 0.9111
294 5XC 0.9110
295 60P 0.9109
296 PRA 0.9109
297 AMC 0.9108
298 173 0.9108
299 1DJ 0.9107
300 IXW 0.9107
301 3OC 0.9107
302 PY7 0.9104
303 261 0.9103
304 9TW 0.9101
305 PKU 0.9100
306 FOC 0.9098
307 CEE 0.9098
308 FCN 0.9096
309 SMV 0.9095
310 3S5 0.9095
311 RBJ 0.9093
312 MD0 0.9093
313 7VD 0.9092
314 MNN 0.9090
315 AC5 0.9089
316 SAN 0.9089
317 SYM 0.9087
318 GOJ 0.9086
319 ACA 0.9085
320 SME 0.9084
321 FLA 0.9084
322 G2H 0.9083
323 HSO 0.9082
324 HBX 0.9082
325 KOJ 0.9081
326 B24 0.9078
327 FBM 0.9078
328 A3B 0.9077
329 DAL DAL 0.9077
330 3HA 0.9076
331 XSP 0.9075
332 3U4 0.9074
333 PAH 0.9074
334 SHA 0.9074
335 2AL 0.9073
336 FSG 0.9073
337 SGL 0.9073
338 JFJ 0.9071
339 5M0 0.9071
340 B40 0.9069
341 282 0.9069
342 MLI 0.9069
343 DTL 0.9068
344 AAS 0.9067
345 EHM 0.9066
346 LEA 0.9065
347 4SV 0.9065
348 GTQ 0.9064
349 DBH 0.9064
350 4LR 0.9063
351 5RG 0.9062
352 I1E 0.9061
353 SMN 0.9058
354 069 0.9057
355 8EW 0.9056
356 F9P 0.9055
357 A09 0.9055
358 F05 0.9055
359 PEZ 0.9054
360 1SP 0.9054
361 3PY 0.9053
362 1GP 0.9053
363 9ON 0.9052
364 3SK 0.9051
365 CYS 0.9051
366 8EZ 0.9046
367 DHS 0.9045
368 BSX 0.9045
369 TSU 0.9043
370 XM0 0.9042
371 M6W 0.9042
372 HDH 0.9041
373 PPV 0.9041
374 54G 0.9040
375 MLA 0.9040
376 54D 0.9040
377 2FT 0.9039
378 SYG 0.9039
379 G3H 0.9038
380 K6V 0.9037
381 RHU 0.9036
382 NM3 0.9036
383 9CL 0.9036
384 OHG 0.9035
385 FA0 0.9034
386 4XR 0.9033
387 NF3 0.9033
388 1LN 0.9032
389 9TZ 0.9031
390 GYE 0.9030
391 HVQ 0.9027
392 BVC 0.9027
393 3HL 0.9027
394 SEP 0.9025
395 DHI 0.9025
396 GP9 0.9024
397 PRY 0.9024
398 JZ4 0.9024
399 AG2 0.9023
400 FUB 0.9023
401 PRI 0.9023
402 23W 0.9022
403 FBA 0.9019
404 FCR 0.9019
405 GAG 0.9017
406 1MR 0.9017
407 GLL 0.9015
408 DOB 0.9014
409 J9T 0.9014
410 SD4 0.9014
411 AEF 0.9014
412 PYF 0.9013
413 SVD 0.9013
414 G3P 0.9013
415 EKZ 0.9012
416 9X6 0.9012
417 9RW 0.9012
418 POP 0.9011
419 8OZ 0.9011
420 WCE 0.9010
421 51R 0.9009
422 FPI 0.9009
423 BNF 0.9008
424 LLQ 0.9007
425 3M0 0.9003
426 0OC 0.9002
427 MEQ 0.9002
428 OHP 0.9001
429 4FA 0.9001
430 UYA 0.9000
431 X0V 0.8999
432 I2M 0.8996
433 YRL 0.8995
434 IPU 0.8995
435 826 0.8994
436 IP0 0.8994
437 4NG 0.8994
438 CDV 0.8993
439 717 0.8992
440 XIY 0.8990
441 HX3 0.8990
442 TYL 0.8990
443 IDM 0.8988
444 4J8 0.8987
445 R1X 0.8987
446 ALA ALA 0.8986
447 CCE 0.8985
448 NM2 0.8985
449 5CU 0.8984
450 NNO 0.8981
451 PGH 0.8978
452 6M4 0.8977
453 BAE 0.8976
454 TB6 0.8975
455 PG0 0.8973
456 HHI 0.8971
457 SYC 0.8970
458 T2C 0.8970
459 7WV 0.8969
460 6NT 0.8969
461 DSN 0.8968
462 6CS 0.8966
463 2CK 0.8965
464 MPD 0.8965
465 3AL 0.8962
466 MZ0 0.8961
467 LNR 0.8960
468 0HN 0.8960
469 4A3 0.8959
470 J9N 0.8958
471 FHB 0.8958
472 GBD 0.8956
473 AMS 0.8955
474 M3H 0.8955
475 ODV 0.8955
476 DMV 0.8953
477 TH7 0.8952
478 R8A 0.8951
479 FBS 0.8951
480 2EZ 0.8950
481 L99 0.8948
482 5HN 0.8947
483 RSF 0.8946
484 1WD 0.8946
485 5MK 0.8945
486 PIM 0.8943
487 1PT 0.8943
488 3NY 0.8942
489 TIU 0.8942
490 R2P 0.8942
491 P2D 0.8940
492 4JM 0.8940
493 MSE 0.8940
494 3HM 0.8939
495 3LR 0.8938
496 MR1 0.8937
497 4JL 0.8937
498 ABA 0.8936
499 265 0.8936
500 2BG 0.8936
501 SER 0.8934
502 URO 0.8932
503 ISD 0.8931
504 5XB 0.8930
505 PCT 0.8930
506 SMB 0.8929
507 280 0.8929
508 PMF 0.8929
509 9J3 0.8927
510 3PG 0.8927
511 ASC 0.8925
512 T9G 0.8924
513 DE5 0.8924
514 NVI 0.8923
515 JAE 0.8923
516 M45 0.8922
517 BRT 0.8920
518 DMG 0.8920
519 PIY 0.8920
520 R9M 0.8919
521 192 0.8919
522 TAG 0.8918
523 KVP 0.8918
524 4M0 0.8918
525 C2B 0.8916
526 BHH 0.8913
527 DE2 0.8913
528 FUD 0.8913
529 B85 0.8912
530 6NI 0.8912
531 JZ3 0.8910
532 PIS 0.8909
533 FBJ 0.8909
534 SDD 0.8909
535 2ZM 0.8908
536 5NU 0.8907
537 NK 0.8906
538 OXQ 0.8906
539 5NI 0.8905
540 0R0 0.8905
541 HG3 0.8902
542 HIU 0.8902
543 1F1 0.8901
544 N8P 0.8901
545 MLM 0.8900
546 BUB 0.8900
547 03W 0.8900
548 LPK 0.8900
549 A8C 0.8900
550 LDU 0.8900
551 QMP 0.8900
552 FK8 0.8899
553 4JT 0.8899
554 I38 0.8898
555 3YP 0.8898
556 HQJ 0.8897
557 VNJ 0.8897
558 278 0.8896
559 OPE 0.8896
560 3F0 0.8895
561 LYS 0.8895
562 IMR 0.8894
563 BHA 0.8894
564 ES9 0.8892
565 HPS 0.8892
566 4SX 0.8890
567 N6C 0.8890
568 RMN 0.8889
569 DYT 0.8889
570 XX2 0.8889
571 NLP 0.8887
572 C2N 0.8887
573 DLY 0.8887
574 PUT 0.8885
575 C2A 0.8881
576 RIB 0.8879
577 ODO 0.8877
578 SOR 0.8877
579 DTU 0.8874
580 RM1 0.8872
581 HUI 0.8872
582 5HY 0.8871
583 AEG 0.8871
584 KG7 0.8870
585 BE7 0.8869
586 DGY 0.8868
587 F60 0.8868
588 MS9 0.8867
589 OSE 0.8866
590 JAB 0.8865
591 AAE 0.8865
592 11S 0.8864
593 S8V 0.8863
594 MTL 0.8861
595 IFP 0.8861
596 14O 0.8861
597 FK1 0.8860
598 ABI 0.8860
599 EDR 0.8860
600 286 0.8860
601 IFM 0.8859
602 BML 0.8858
603 URF 0.8857
604 5MB 0.8857
605 PHE 0.8856
606 DCY 0.8855
607 GRO 0.8854
608 HHA 0.8854
609 3BU 0.8853
610 4JU 0.8851
611 OXZ 0.8851
612 FA1 0.8850
613 5H1 0.8850
614 6AI 0.8849
615 LDP 0.8845
616 3HR 0.8845
617 AOS 0.8842
618 S2P 0.8841
619 174 0.8840
620 JZ1 0.8839
621 2PN 0.8839
622 O7U 0.8835
623 FYU 0.8834
624 ABV 0.8832
625 DPF 0.8832
626 7MU 0.8831
627 HMH 0.8831
628 3XX 0.8828
629 QFH 0.8827
630 GPJ 0.8826
631 GPF 0.8826
632 DXX 0.8825
633 4FH 0.8823
634 264 0.8818
635 J9Q 0.8818
636 4HP 0.8818
637 5MI 0.8817
638 KTA 0.8816
639 2MH 0.8814
640 KPL 0.8813
641 2XX 0.8812
642 DII 0.8812
643 DMD 0.8811
644 N7P 0.8811
645 H4N 0.8811
646 IQ0 0.8811
647 JZ9 0.8810
648 4SD 0.8809
649 2K4 0.8809
650 SAT 0.8808
651 GLO 0.8808
652 BVG 0.8807
653 SHV 0.8807
654 K6H 0.8806
655 WTZ 0.8804
656 DBB 0.8803
657 SHI 0.8801
658 6M9 0.8800
659 PBE 0.8797
660 LRH 0.8795
661 4CH 0.8795
662 CCD 0.8794
663 CYX 0.8793
664 RAT 0.8791
665 SW7 0.8789
666 PO6 0.8785
667 J1Z 0.8785
668 LT2 0.8784
669 F31 0.8782
670 2RA 0.8782
671 LFC 0.8782
672 MDN 0.8782
673 263 0.8781
674 3FH 0.8780
675 52C 0.8779
676 47J 0.8778
677 PC 0.8778
678 0CT 0.8777
679 DPR 0.8776
680 DEN 0.8776
681 NCT 0.8776
682 SOL 0.8775
683 5RN 0.8775
684 42J 0.8774
685 DHR 0.8773
686 2TQ 0.8771
687 A20 0.8768
688 AX7 0.8768
689 EYK 0.8768
690 IT9 0.8765
691 2FY 0.8763
692 C5J 0.8762
693 DFB 0.8761
694 AT3 0.8761
695 SN4 0.8760
696 IPB 0.8759
697 CHT 0.8757
698 152 0.8755
699 MZT 0.8754
700 23B 0.8754
701 JDN 0.8751
702 2DR 0.8750
703 PSJ 0.8748
704 3SS 0.8748
705 2MI 0.8748
706 H8N 0.8747
707 BZI 0.8747
708 GZL 0.8747
709 WBU 0.8746
710 RUJ 0.8745
711 KYD 0.8745
712 IND 0.8740
713 NOJ 0.8733
714 L3Q 0.8732
715 COM 0.8731
716 VX 0.8730
717 270 0.8729
718 APG 0.8724
719 LZ1 0.8723
720 ICN 0.8721
721 5WV 0.8721
722 EOU 0.8719
723 DHK 0.8719
724 DBX 0.8719
725 AZF 0.8718
726 ZXD 0.8718
727 G8M 0.8717
728 34V 0.8716
729 QUZ 0.8714
730 GBN 0.8713
731 3HP 0.8710
732 ETM 0.8708
733 MZG 0.8708
734 MCT 0.8706
735 BHL 0.8705
736 XPO 0.8704
737 NSP 0.8704
738 RUY 0.8698
739 TAU 0.8696
740 DOR 0.8695
741 92K 0.8693
742 BZF 0.8692
743 32O 0.8691
744 4JP 0.8691
745 MWM 0.8690
746 FPK 0.8690
747 PCR 0.8689
748 AMH 0.8688
749 4HA 0.8687
750 PLQ 0.8687
751 9EW 0.8686
752 BXO 0.8686
753 HHH 0.8686
754 JBE 0.8685
755 5JC 0.8684
756 H3M 0.8683
757 JB8 0.8683
758 HQE 0.8680
759 911 0.8679
760 TH0 0.8678
761 4HO 0.8677
762 CXP 0.8676
763 24B 0.8675
764 GVG 0.8675
765 ET2 0.8674
766 PE9 0.8674
767 4ZE 0.8674
768 G2F 0.8673
769 RUU 0.8670
770 NPY 0.8670
771 HPY 0.8669
772 ARA 0.8669
773 SX1 0.8668
774 ES7 0.8666
775 23J 0.8664
776 2YU 0.8662
777 HCI 0.8660
778 97T 0.8660
779 XIZ 0.8659
780 MPI 0.8658
781 A29 0.8658
782 PXY 0.8657
783 BGC 0.8655
784 PBA 0.8654
785 KDG 0.8650
786 0R1 0.8648
787 LG4 0.8647
788 3ID 0.8647
789 GOL 0.8645
790 JF6 0.8643
791 ASO 0.8642
792 DCD 0.8642
793 KVV 0.8641
794 Z6J 0.8641
795 G4D 0.8640
796 SKM 0.8638
797 BMD 0.8638
798 GIF 0.8636
799 DUC 0.8636
800 HMU 0.8636
801 BTL 0.8636
802 LCN 0.8636
803 MSR 0.8635
804 1SH 0.8633
805 XBZ 0.8631
806 WOT 0.8630
807 DFU 0.8629
808 DA1 0.8627
809 XYS 0.8627
810 1AC 0.8625
811 GVH 0.8625
812 FPN 0.8624
813 8SZ 0.8622
814 AGK 0.8621
815 IFL 0.8620
816 IPM 0.8620
817 BNL 0.8620
818 DGJ 0.8619
819 3DO 0.8617
820 34A 0.8616
821 XAP 0.8614
822 TDR 0.8613
823 R20 0.8613
824 6M1 0.8611
825 F4E 0.8611
826 HT4 0.8611
827 DPN 0.8606
828 GLC 0.8606
829 25R 0.8603
830 TM7 0.8603
831 2AC 0.8602
832 3GR 0.8600
833 BR9 0.8598
834 1MC 0.8595
835 EFS 0.8593
836 4JN 0.8592
837 BAL 0.8592
838 Q03 0.8586
839 HLR 0.8580
840 A1U 0.8579
841 2HU 0.8579
842 XQ0 0.8575
843 4BZ 0.8573
844 IF7 0.8572
845 4HS 0.8568
846 SAR 0.8567
847 4PN 0.8566
848 GAL 0.8564
849 2F6 0.8560
850 5MH 0.8556
851 SNU 0.8554
852 BDP 0.8550
853 KP6 0.8548
854 PH3 0.8545
855 41K 0.8536
856 NOY 0.8518
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5I60; Ligand: 67W; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 5i60.bio1) has 41 residues
No: Leader PDB Ligand Sequence Similarity
1 6XU3 PLP 24.3902
2 6XU3 PLP 24.3902
Pocket No.: 2; Query (leader) PDB : 5I60; Ligand: 67W; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 5i60.bio1) has 41 residues
No: Leader PDB Ligand Sequence Similarity
1 6XU3 PLP 24.3902
2 6XU3 PLP 24.3902
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