Receptor
PDB id Resolution Class Description Source Keywords
5DX7 2.1 Å EC: 2.3.3.9 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS MALATE SYNTH COMPLEX WITH 5-(5-CHLOROTHIOPHEN-2-YL)ISOXAZOLE-3-CARBOXYLI MYCOBACTERIUM TUBERCULOSIS (STRAIN ATCH37RV) ACETYLTRANSFERASE TRANSFERASE
Ref.: MYCOBACTERIUM TUBERCULOSIS MALATE SYNTHASE STRUCTUR FRAGMENTS REVEAL A PORTAL FOR SUBSTRATE/PRODUCT EXC J. BIOL. CHEM. V. 291 27421 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:801;
 Part of Protein;
 none;
 submit data
24.305 Mg [Mg+2...
5H6 A:802;
 Valid;
 none;
 submit data
229.64 C8 H4 Cl N O3 S c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6C6O 2.3 Å EC: 2.3.3.9 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS MALATE SYNTH COMPLEX WITH 2-BR-4-OH-PHENYLDIKETOACID MYCOBACTERIUM TUBERCULOSIS ACETYLTRANSFERASE STRUCTURAL GENOMICS TB STRUCTURAL GENOMICONSORTIUM TBSGC TRANSFERASE TRANSFERASE-TRANSFERASE INHCOMPLEX
Ref.: ANION-PI INTERACTIONS IN COMPUTER-AIDED DRUG DESIGN MODELING THE INHIBITION OF MALATE SYNTHASE BY PHENY ACIDS. J CHEM INF MODEL V. 58 2085 2018
Members (34)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 6BU1 ic50 = 0.06 uM E9S C10 H7 Br O5 c1cc(c(c(c....
2 5C9W - 4Z3 C8 H7 Br N2 O2 c1ccc(c(c1....
3 6C8P ic50 = 0.2 uM EQA C10 H7 F O4 c1ccc(c(c1....
4 5DRC - 5ER C12 H9 N O4 c1ccc2c(c1....
5 5DX7 - 5H6 C8 H4 Cl N O3 S c1cc(sc1c2....
6 5ECV - 5M2 C13 H11 N O4 Cc1c2cc[nH....
7 5CBB - 4ZF C12 H9 N3 O2 c1ccc2c(c1....
8 5C7V - PYC C5 H4 N O2 c1cc([nH]c....
9 2GQ3 - MLT C4 H6 O5 C([C@H](C(....
10 5E9X - 5LA C7 H4 Cl N O2 S c1c2cc(sc2....
11 5C9U - 4Z1 C8 H6 Cl2 N2 O3 c1cc(c(cc1....
12 6BA7 ic50 = 0.007 uM D1Y C10 H7 Cl O5 c1cc(c(cc1....
13 5CBI - 4ZC C7 H4 Cl N O c1cc(c(cc1....
14 1N8I - GLV C2 H2 O3 C(=O)C(=O)....
15 5C9R - 4YZ C9 H9 Cl O2 S c1cc(ccc1S....
16 5CBJ - 4ZD C9 H8 O2 S c1ccc(cc1)....
17 5CAH - 4ZA C7 H5 N O2 S c1csc2c1cc....
18 5C9X - 4Z4 C7 H3 Cl2 F O2 c1c(c(cc(c....
19 6AS6 ic50 = 15.2 uM BSV C14 H14 O4 Cc1ccc(cc1....
20 5CJN - 52F C11 H10 N2 O3 c1ccc2c(c1....
21 6DNP ic50 = 6.6 uM GZV C11 H8 F2 O4 Cc1ccc(c(c....
22 5CCZ - 50C C10 H10 F N3 Cc1c(n[nH]....
23 6DKO ic50 = 1.6 uM GXG C10 H6 F2 O4 c1cc(c(c(c....
24 6C6O ic50 = 0.005 uM ENG C10 H7 Br O5 c1cc(c(cc1....
25 6APZ ic50 = 0.15 uM BQ4 C10 H8 O5 c1cc(cc(c1....
26 6AXB ic50 = 0.5 uM C0V C14 H10 O4 c1ccc2cc(c....
27 6C7B ic50 = 1.5 uM ENY C15 H12 O5 COc1ccc2cc....
28 5CEW - 6MW C9 H10 N2 O2 S c1cnccc1[C....
29 5CAK - 4Z9 C11 H11 N O3 c1ccc2c(c1....
30 6ASU ic50 = 6.1 uM BVS C11 H10 O4 Cc1ccc(cc1....
31 6AU9 ic50 = 1.1 uM BXS C12 H10 O6 c1cc2c(cc1....
32 5CJM - 4WL C7 H5 N O2 S c1csc2c1[n....
33 6DL9 ic50 = 1 uM GXD C10 H6 Cl2 O4 c1cc(c(c(c....
34 5T8G - 4Z0 C9 H6 O5 S c1cc(sc1)C....
70% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 6BU1 ic50 = 0.06 uM E9S C10 H7 Br O5 c1cc(c(c(c....
2 5C9W - 4Z3 C8 H7 Br N2 O2 c1ccc(c(c1....
3 6C8P ic50 = 0.2 uM EQA C10 H7 F O4 c1ccc(c(c1....
4 5DRC - 5ER C12 H9 N O4 c1ccc2c(c1....
5 5DX7 - 5H6 C8 H4 Cl N O3 S c1cc(sc1c2....
6 5ECV - 5M2 C13 H11 N O4 Cc1c2cc[nH....
7 5CBB - 4ZF C12 H9 N3 O2 c1ccc2c(c1....
8 5C7V - PYC C5 H4 N O2 c1cc([nH]c....
9 6C7B ic50 = 1.5 uM ENY C15 H12 O5 COc1ccc2cc....
10 5CEW - 6MW C9 H10 N2 O2 S c1cnccc1[C....
11 5CAK - 4Z9 C11 H11 N O3 c1ccc2c(c1....
12 6ASU ic50 = 6.1 uM BVS C11 H10 O4 Cc1ccc(cc1....
13 6AU9 ic50 = 1.1 uM BXS C12 H10 O6 c1cc2c(cc1....
14 5CJM - 4WL C7 H5 N O2 S c1csc2c1[n....
15 6DL9 ic50 = 1 uM GXD C10 H6 Cl2 O4 c1cc(c(c(c....
16 5T8G - 4Z0 C9 H6 O5 S c1cc(sc1)C....
50% Homology Family (35)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 6BU1 ic50 = 0.06 uM E9S C10 H7 Br O5 c1cc(c(c(c....
2 5C9W - 4Z3 C8 H7 Br N2 O2 c1ccc(c(c1....
3 6C8P ic50 = 0.2 uM EQA C10 H7 F O4 c1ccc(c(c1....
4 5DRC - 5ER C12 H9 N O4 c1ccc2c(c1....
5 5DX7 - 5H6 C8 H4 Cl N O3 S c1cc(sc1c2....
6 5ECV - 5M2 C13 H11 N O4 Cc1c2cc[nH....
7 5CBB - 4ZF C12 H9 N3 O2 c1ccc2c(c1....
8 5C7V - PYC C5 H4 N O2 c1cc([nH]c....
9 2GQ3 - MLT C4 H6 O5 C([C@H](C(....
10 5E9X - 5LA C7 H4 Cl N O2 S c1c2cc(sc2....
11 5C9U - 4Z1 C8 H6 Cl2 N2 O3 c1cc(c(cc1....
12 6BA7 ic50 = 0.007 uM D1Y C10 H7 Cl O5 c1cc(c(cc1....
13 5CBI - 4ZC C7 H4 Cl N O c1cc(c(cc1....
14 1N8I - GLV C2 H2 O3 C(=O)C(=O)....
15 5C9R - 4YZ C9 H9 Cl O2 S c1cc(ccc1S....
16 5CBJ - 4ZD C9 H8 O2 S c1ccc(cc1)....
17 5CAH - 4ZA C7 H5 N O2 S c1csc2c1cc....
18 5C9X - 4Z4 C7 H3 Cl2 F O2 c1c(c(cc(c....
19 6AS6 ic50 = 15.2 uM BSV C14 H14 O4 Cc1ccc(cc1....
20 5CJN - 52F C11 H10 N2 O3 c1ccc2c(c1....
21 6DNP ic50 = 6.6 uM GZV C11 H8 F2 O4 Cc1ccc(c(c....
22 5CCZ - 50C C10 H10 F N3 Cc1c(n[nH]....
23 6DKO ic50 = 1.6 uM GXG C10 H6 F2 O4 c1cc(c(c(c....
24 6C6O ic50 = 0.005 uM ENG C10 H7 Br O5 c1cc(c(cc1....
25 6APZ ic50 = 0.15 uM BQ4 C10 H8 O5 c1cc(cc(c1....
26 6AXB ic50 = 0.5 uM C0V C14 H10 O4 c1ccc2cc(c....
27 6C7B ic50 = 1.5 uM ENY C15 H12 O5 COc1ccc2cc....
28 5CEW - 6MW C9 H10 N2 O2 S c1cnccc1[C....
29 5CAK - 4Z9 C11 H11 N O3 c1ccc2c(c1....
30 6ASU ic50 = 6.1 uM BVS C11 H10 O4 Cc1ccc(cc1....
31 6AU9 ic50 = 1.1 uM BXS C12 H10 O6 c1cc2c(cc1....
32 5CJM - 4WL C7 H5 N O2 S c1csc2c1[n....
33 6DL9 ic50 = 1 uM GXD C10 H6 Cl2 O4 c1cc(c(c(c....
34 5T8G - 4Z0 C9 H6 O5 S c1cc(sc1)C....
35 1D8C - SOR C6 H14 O6 C([C@@H]([....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 5H6; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 5H6 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 5H6; Similar ligands found: 552
No: Ligand Similarity coefficient
1 G14 0.9837
2 ZZA 0.9770
3 3VQ 0.9717
4 ODK 0.9609
5 0K7 0.9584
6 KLE 0.9567
7 JMG 0.9565
8 6MW 0.9476
9 S0D 0.9467
10 A9B 0.9459
11 7O4 0.9453
12 Y3L 0.9448
13 4FF 0.9445
14 PUE 0.9441
15 FHV 0.9429
16 9FH 0.9429
17 5VU 0.9417
18 P7V 0.9410
19 AJG 0.9405
20 B1J 0.9395
21 LR8 0.9389
22 E3X 0.9389
23 PQM 0.9359
24 78Y 0.9358
25 6SD 0.9357
26 2D2 0.9356
27 8CC 0.9353
28 TMG 0.9351
29 8D6 0.9350
30 6FG 0.9350
31 6C8 0.9329
32 GVY 0.9328
33 VC3 0.9323
34 M83 0.9308
35 5TO 0.9308
36 L1T 0.9306
37 363 0.9305
38 RA7 0.9300
39 BVS 0.9299
40 1XS 0.9298
41 0NX 0.9291
42 L03 0.9291
43 XCG 0.9285
44 QIV 0.9285
45 4HB 0.9282
46 M4N 0.9278
47 5F8 0.9273
48 795 0.9267
49 6KT 0.9266
50 6P3 0.9264
51 6C5 0.9260
52 TCR 0.9253
53 2PV 0.9253
54 TJM 0.9253
55 5TZ 0.9248
56 LZ5 0.9246
57 4AU 0.9246
58 K3D 0.9244
59 HNT 0.9243
60 6C4 0.9241
61 BIK 0.9240
62 D25 0.9239
63 833 0.9239
64 VM1 0.9238
65 F4K 0.9232
66 2PK 0.9228
67 FCD 0.9227
68 YE6 0.9227
69 KLS 0.9225
70 3VS 0.9218
71 A6W 0.9216
72 7FU 0.9215
73 7MW 0.9214
74 NK5 0.9205
75 2P3 0.9205
76 5FL 0.9198
77 D3G 0.9196
78 J1K 0.9192
79 LL1 0.9191
80 0UL 0.9189
81 5O6 0.9189
82 AJ1 0.9184
83 D9Z 0.9182
84 GJG 0.9181
85 9NB 0.9181
86 FMQ 0.9175
87 2FX 0.9171
88 PRL 0.9167
89 FZM 0.9163
90 K48 0.9160
91 4I8 0.9158
92 1EB 0.9157
93 VBC 0.9155
94 JSX 0.9152
95 TID 0.9152
96 5C1 0.9150
97 A5H 0.9150
98 S1D 0.9150
99 SOJ 0.9150
100 EQW 0.9150
101 Q4G 0.9149
102 QME 0.9148
103 BP7 0.9148
104 1FE 0.9146
105 GO2 0.9145
106 PQS 0.9145
107 5E5 0.9143
108 1HP 0.9139
109 XI7 0.9135
110 SX2 0.9133
111 P93 0.9130
112 92G 0.9128
113 S7S 0.9127
114 0ON 0.9126
115 JAH 0.9121
116 X48 0.9121
117 RKV 0.9109
118 C4E 0.9107
119 6C9 0.9106
120 68B 0.9103
121 RSV 0.9097
122 0SY 0.9096
123 P4T 0.9094
124 90G 0.9091
125 5TY 0.9088
126 EWG 0.9087
127 IS2 0.9085
128 II4 0.9084
129 VGS 0.9083
130 TYR 0.9081
131 4CN 0.9079
132 492 0.9078
133 4MB 0.9078
134 OLU 0.9076
135 5B2 0.9076
136 WA1 0.9076
137 8V8 0.9075
138 0LO 0.9074
139 NDD 0.9073
140 STX 0.9072
141 FYR 0.9069
142 TRP 0.9069
143 JA5 0.9065
144 I3E 0.9065
145 VFJ 0.9059
146 D1G 0.9059
147 4NP 0.9058
148 47V 0.9058
149 N9M 0.9058
150 ZRK 0.9053
151 VFG 0.9050
152 C82 0.9049
153 MKN 0.9048
154 4G2 0.9046
155 NFZ 0.9041
156 6FB 0.9041
157 GB5 0.9040
158 5TT 0.9037
159 PIQ 0.9036
160 A98 0.9035
161 H75 0.9035
162 9BF 0.9034
163 LFQ 0.9033
164 RDV 0.9028
165 7EH 0.9028
166 0DF 0.9026
167 1A5 0.9023
168 IWT 0.9020
169 KW7 0.9018
170 ENO 0.9015
171 9JT 0.9014
172 CPZ 0.9011
173 DHC 0.9011
174 MSR 0.9010
175 OJD 0.9010
176 4UM 0.9006
177 4V2 0.9005
178 OHJ 0.9004
179 AZM 0.9003
180 HX4 0.9003
181 2JX 0.9002
182 6ZX 0.8999
183 MD6 0.8997
184 613 0.8997
185 50C 0.8996
186 VFM 0.8995
187 AVX 0.8994
188 272 0.8994
189 FCW 0.8993
190 856 0.8991
191 5F5 0.8986
192 JBZ 0.8986
193 D26 0.8986
194 LEL 0.8984
195 DTR 0.8983
196 RGK 0.8983
197 ZTW 0.8983
198 IOP 0.8983
199 J9N 0.8982
200 F40 0.8982
201 SWX 0.8981
202 K7H 0.8979
203 6H2 0.8978
204 SQV 0.8976
205 YIP 0.8974
206 49P 0.8973
207 A5Q 0.8973
208 DBE 0.8973
209 TIA 0.8973
210 B21 0.8972
211 KF5 0.8971
212 AMR 0.8971
213 ERZ 0.8970
214 BMC 0.8970
215 54E 0.8967
216 HC4 0.8964
217 0XR 0.8962
218 4BL 0.8962
219 4BX 0.8961
220 9UL 0.8959
221 2QC 0.8956
222 4NS 0.8950
223 L2K 0.8949
224 A5E 0.8946
225 37E 0.8946
226 RYV 0.8944
227 9FG 0.8943
228 U4J 0.8942
229 JFS 0.8941
230 3IL 0.8941
231 0OY 0.8940
232 397 0.8940
233 LO1 0.8939
234 28A 0.8938
235 NAL 0.8937
236 3VW 0.8936
237 U13 0.8933
238 A73 0.8933
239 FQX 0.8933
240 N9J 0.8932
241 YZM 0.8930
242 SNU 0.8929
243 4BY 0.8927
244 N91 0.8927
245 3QV 0.8926
246 SZ5 0.8924
247 IDZ 0.8923
248 25F 0.8922
249 EN1 0.8922
250 A7H 0.8916
251 AES 0.8916
252 4Z1 0.8915
253 X6W 0.8915
254 3F4 0.8914
255 27K 0.8913
256 P81 0.8912
257 4FE 0.8911
258 4LW 0.8910
259 5GV 0.8907
260 JF8 0.8903
261 HXY 0.8902
262 20D 0.8902
263 FC2 0.8901
264 4NR 0.8901
265 1V1 0.8901
266 RVE 0.8901
267 WLH 0.8900
268 SSC 0.8900
269 0OK 0.8900
270 PPY 0.8899
271 ATX 0.8898
272 HH6 0.8898
273 FER 0.8898
274 XDK 0.8897
275 7G2 0.8896
276 S0E 0.8895
277 JF5 0.8895
278 F18 0.8895
279 1AJ 0.8893
280 AVA 0.8893
281 BBY 0.8893
282 Q0K 0.8893
283 GB4 0.8890
284 WVV 0.8890
285 ZEA 0.8889
286 4ZF 0.8889
287 36M 0.8888
288 HRM 0.8887
289 GT4 0.8886
290 ALE 0.8885
291 3R4 0.8883
292 YE7 0.8883
293 A8D 0.8882
294 4LV 0.8882
295 IQW 0.8881
296 1SF 0.8881
297 N1E 0.8880
298 27M 0.8880
299 20N 0.8879
300 72D 0.8879
301 80G 0.8879
302 J6W 0.8878
303 KMY 0.8875
304 7G0 0.8874
305 657 0.8872
306 DFL 0.8869
307 3W6 0.8867
308 ITE 0.8866
309 3W3 0.8864
310 F4E 0.8864
311 3VX 0.8863
312 DXK 0.8861
313 0FR 0.8861
314 A7Q 0.8860
315 7KE 0.8859
316 7N8 0.8859
317 8NB 0.8859
318 EUE 0.8858
319 MR4 0.8857
320 EV2 0.8856
321 4Z9 0.8855
322 RGP 0.8854
323 EAT 0.8854
324 P80 0.8853
325 PNP 0.8852
326 FF2 0.8852
327 5LA 0.8851
328 SNO 0.8850
329 9CE 0.8850
330 3D8 0.8850
331 4FP 0.8848
332 BX4 0.8848
333 11X 0.8847
334 AD6 0.8846
335 5OR 0.8844
336 I2E 0.8843
337 5AD 0.8841
338 36Y 0.8839
339 3ZB 0.8839
340 G2V 0.8837
341 C1M 0.8836
342 RD4 0.8835
343 2QU 0.8832
344 8YH 0.8830
345 C53 0.8828
346 GOE 0.8827
347 2J1 0.8824
348 D2G 0.8823
349 TZF 0.8821
350 X0U 0.8821
351 PH3 0.8820
352 MJW 0.8819
353 S8P 0.8819
354 A05 0.8817
355 5OO 0.8815
356 DAH 0.8813
357 DTY 0.8813
358 5S9 0.8810
359 428 0.8810
360 7VP 0.8809
361 UNJ 0.8807
362 2GQ 0.8806
363 MR5 0.8806
364 7L4 0.8804
365 K4V 0.8804
366 EZL 0.8803
367 245 0.8802
368 5SJ 0.8802
369 CXH 0.8801
370 M5H 0.8801
371 AWE 0.8801
372 1PS 0.8800
373 BL0 0.8800
374 OQC 0.8799
375 KWB 0.8799
376 NIY 0.8799
377 RNO 0.8799
378 JGB 0.8798
379 AN3 0.8798
380 3SU 0.8797
381 L15 0.8794
382 PTB 0.8794
383 N4E 0.8793
384 EES 0.8793
385 08C 0.8791
386 4GU 0.8790
387 U7E 0.8789
388 6DH 0.8786
389 J38 0.8786
390 ENW 0.8785
391 BC5 0.8784
392 A51 0.8784
393 5ER 0.8784
394 CC5 0.8784
395 RF2 0.8783
396 LVD 0.8783
397 KWV 0.8780
398 F02 0.8777
399 LJ3 0.8775
400 EZ1 0.8774
401 28B 0.8774
402 NY4 0.8774
403 L5D 0.8772
404 JCZ 0.8767
405 MR6 0.8766
406 S60 0.8765
407 SSY 0.8764
408 KP2 0.8761
409 UN3 0.8759
410 14W 0.8759
411 TYC 0.8758
412 ARG 0.8758
413 K82 0.8754
414 BNL 0.8754
415 WCU 0.8754
416 PZ8 0.8754
417 2WU 0.8751
418 AUV 0.8748
419 HNH 0.8748
420 M78 0.8747
421 YZ9 0.8745
422 BVA 0.8744
423 BPY 0.8743
424 TB8 0.8743
425 PFF 0.8741
426 549 0.8738
427 LC1 0.8737
428 XYP XYP 0.8737
429 4XF 0.8736
430 S62 0.8733
431 60L 0.8731
432 STV 0.8731
433 58X 0.8730
434 Q9T 0.8729
435 P4L 0.8729
436 SLS 0.8728
437 IPO 0.8727
438 H4B 0.8725
439 S8G 0.8722
440 MGB 0.8721
441 CBE 0.8720
442 IQQ 0.8718
443 0NJ 0.8716
444 3CX 0.8715
445 BQ2 0.8714
446 4AF 0.8713
447 D1Y 0.8713
448 6DQ 0.8711
449 94W 0.8711
450 B15 0.8711
451 1Z6 0.8710
452 HPP 0.8708
453 3DE 0.8704
454 LPA 0.8703
455 LIG 0.8703
456 S0A 0.8701
457 GGB 0.8699
458 ZHA 0.8698
459 J84 0.8698
460 AOT 0.8696
461 S98 0.8695
462 7FZ 0.8693
463 P9E 0.8692
464 5DS 0.8691
465 HRD 0.8690
466 0F3 0.8690
467 OOG 0.8688
468 KNA 0.8687
469 FT6 0.8681
470 MZM 0.8675
471 D8Q 0.8674
472 4CF 0.8674
473 A7N 0.8673
474 SNV 0.8673
475 92O 0.8672
476 A63 0.8672
477 CFA 0.8670
478 ZRL 0.8662
479 QBP 0.8659
480 LJ4 0.8659
481 GRQ 0.8657
482 2QV 0.8656
483 1V4 0.8656
484 GZ2 0.8655
485 EQA 0.8654
486 AOY 0.8653
487 CWJ 0.8649
488 BSU 0.8648
489 BGU 0.8648
490 JVD 0.8645
491 LOT 0.8644
492 EIP 0.8644
493 HL6 0.8642
494 ZEC 0.8641
495 TOH 0.8640
496 NE2 0.8639
497 1ER 0.8638
498 4EU 0.8633
499 26C 0.8632
500 72G 0.8631
501 GLY GLY GLY 0.8629
502 CIY 0.8629
503 DVK 0.8626
504 27F 0.8625
505 72E 0.8623
506 GVA 0.8623
507 KTJ 0.8622
508 M28 0.8622
509 XYP XIF 0.8619
510 XIF XYP 0.8619
511 GHQ 0.8619
512 IPJ 0.8618
513 1KN 0.8618
514 KYN 0.8614
515 PZX 0.8610
516 K0G 0.8606
517 3W8 0.8606
518 BSA 0.8602
519 52F 0.8597
520 IIH 0.8595
521 5RP 0.8591
522 WV7 0.8589
523 SKF 0.8585
524 SB7 0.8584
525 RCV 0.8584
526 IYR 0.8582
527 801 0.8581
528 IBP 0.8580
529 5P3 0.8579
530 4AB 0.8579
531 Z3R 0.8577
532 HIC 0.8577
533 QTD 0.8573
534 1UZ 0.8571
535 XDN XYP 0.8563
536 XYP XDN 0.8563
537 D64 0.8556
538 4Z3 0.8555
539 PML 0.8555
540 5WN 0.8549
541 G1L 0.8542
542 FWD 0.8540
543 EUH 0.8538
544 DED 0.8535
545 S0F 0.8535
546 BMZ 0.8534
547 EI1 0.8534
548 CWD 0.8530
549 CR4 0.8527
550 HL4 0.8527
551 NPX 0.8523
552 FTV 0.8520
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6C6O; Ligand: ENG; Similar sites found with APoc: 4
This union binding pocket(no: 1) in the query (biounit: 6c6o.bio1) has 36 residues
No: Leader PDB Ligand Sequence Similarity
1 4L9Z OXL 5.01475
2 4L9Z OXL 5.01475
3 4L9Z OXL 5.01475
4 4L9Z OXL 5.01475
APoc FAQ
Feedback