Receptor
PDB id Resolution Class Description Source Keywords
5CAH 2.3 Å EC: 2.3.3.9 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS MALATE SYNTH COMPLEX WITH 6H-THIENO[2,3-B]PYRROLE-5-CARBOXYLIC ACID MYCOBACTERIUM TUBERCULOSIS (STRAIN ATCH37RV) FRAGMENT COMPLEX 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:802;
A:801;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
24.305 Mg [Mg+2...
4ZA A:803;
 Valid;
 none;
 submit data
167.185 C7 H5 N O2 S c1csc...
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 (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2GQ3 - MLT C4 H6 O5 C([C@H](C(....
2 5E9X - 5LA C7 H4 Cl N O2 S c1c2cc(sc2....
3 5C9U - 4Z1 C8 H6 Cl2 N2 O3 c1cc(c(cc1....
4 6BA7 ic50 = 0.007 uM D1Y C10 H7 Cl O5 c1cc(c(cc1....
5 5CBI - 4ZC C7 H4 Cl N O c1cc(c(cc1....
6 1N8I - GLV C2 H2 O3 C(=O)C(=O)....
7 5C9R - 4YZ C9 H9 Cl O2 S c1cc(ccc1S....
8 5CBJ - 4ZD C9 H8 O2 S c1ccc(cc1)....
9 5CAH - 4ZA C7 H5 N O2 S c1csc2c1cc....
10 5C9X - 4Z4 C7 H3 Cl2 F O2 c1c(c(cc(c....
11 6AS6 ic50 = 15.2 uM BSV C14 H14 O4 Cc1ccc(cc1....
12 5CJN - 52F C11 H10 N2 O3 c1ccc2c(c1....
13 6DNP ic50 = 6.6 uM GZV C11 H8 F2 O4 Cc1ccc(c(c....
14 5CCZ - 50C C10 H10 F N3 Cc1c(n[nH]....
15 6DKO ic50 = 1.6 uM GXG C10 H6 F2 O4 c1cc(c(c(c....
16 6C6O ic50 = 0.005 uM ENG C10 H7 Br O5 c1cc(c(cc1....
17 6APZ ic50 = 0.15 uM BQ4 C10 H8 O5 c1cc(cc(c1....
18 6AXB ic50 = 0.5 uM C0V C14 H10 O4 c1ccc2cc(c....
19 1D8C - SOR C6 H14 O6 C([C@@H]([....
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: 4ZA; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 4ZA 1 1
2 4WL 0.425532 0.965517
3 5LA 0.416667 0.852941
Similar Ligands (3D)
Ligand no: 1; Ligand: 4ZA; Similar ligands found: 1046
No: Ligand Similarity coefficient
1 BZ2 0.9986
2 4P5 0.9968
3 ICB 0.9892
4 ESP 0.9840
5 ESX 0.9767
6 6NT 0.9754
7 PHB 0.9753
8 JLZ 0.9743
9 INO 0.9736
10 F4E 0.9731
11 HBD 0.9728
12 6FZ 0.9703
13 PAB 0.9700
14 MSR 0.9691
15 0HN 0.9690
16 1Y6 0.9684
17 DHB 0.9674
18 2ZM 0.9671
19 NPO 0.9671
20 0HO 0.9670
21 XIY 0.9665
22 PIM 0.9657
23 1F1 0.9655
24 5NI 0.9653
25 2HU 0.9647
26 FHB 0.9644
27 NNO 0.9642
28 P9P 0.9632
29 3HM 0.9630
30 3NY 0.9625
31 2HO 0.9625
32 4MA 0.9625
33 4A3 0.9624
34 6NI 0.9614
35 JAW 0.9614
36 CHB 0.9605
37 E5X 0.9602
38 PO6 0.9601
39 PBZ 0.9600
40 4NC 0.9597
41 1M2 0.9584
42 PIY 0.9581
43 SNU 0.9580
44 ANN 0.9577
45 93K 0.9576
46 717 0.9574
47 826 0.9569
48 IHB 0.9560
49 36E 0.9559
50 MYJ 0.9558
51 PNZ 0.9555
52 4NB 0.9554
53 2BG 0.9553
54 TYL 0.9549
55 3A9 0.9548
56 15N 0.9548
57 TCA 0.9544
58 3PF 0.9543
59 JDN 0.9537
60 5QY 0.9535
61 TZF 0.9532
62 ABI 0.9527
63 QSB 0.9523
64 J9Q 0.9523
65 AC6 0.9521
66 BPN 0.9520
67 SW7 0.9513
68 Z82 0.9510
69 2HC 0.9506
70 0JD 0.9503
71 0BP 0.9500
72 174 0.9497
73 4BZ 0.9497
74 M3H 0.9493
75 CPZ 0.9490
76 8WO 0.9485
77 9TW 0.9483
78 D48 0.9482
79 SN4 0.9475
80 4BY 0.9474
81 HQJ 0.9472
82 CFI 0.9469
83 JB8 0.9466
84 L14 0.9464
85 ESI 0.9464
86 XX2 0.9462
87 LQ2 0.9460
88 HHI 0.9457
89 PHU 0.9454
90 9FL 0.9449
91 6TZ 0.9448
92 K34 0.9439
93 36Y 0.9431
94 AKG 0.9429
95 BNL 0.9428
96 3ZB 0.9420
97 9CA 0.9419
98 HC4 0.9417
99 L5V 0.9417
100 TPA 0.9415
101 ISZ 0.9415
102 G3E 0.9412
103 UNJ 0.9410
104 M4T 0.9406
105 H42 0.9403
106 97T 0.9401
107 8ZE 0.9398
108 5XC 0.9397
109 PAC 0.9397
110 SLS 0.9393
111 XIZ 0.9393
112 HIS 0.9393
113 HDH 0.9391
114 428 0.9391
115 BEZ 0.9391
116 E1T 0.9389
117 BZ3 0.9386
118 GVG 0.9382
119 R20 0.9380
120 LNR 0.9378
121 5OB 0.9377
122 4NM 0.9376
123 IWT 0.9374
124 4FA 0.9374
125 HX4 0.9368
126 DMD 0.9367
127 J5I 0.9364
128 OTR 0.9362
129 FK8 0.9357
130 DHR 0.9354
131 PPY 0.9351
132 2MI 0.9350
133 HCI 0.9350
134 1IT 0.9349
135 AX7 0.9349
136 MPV 0.9348
137 ZXD 0.9346
138 F31 0.9346
139 FA0 0.9346
140 BHO 0.9346
141 JB5 0.9343
142 TSU 0.9340
143 COU 0.9338
144 C1M 0.9337
145 4BL 0.9337
146 AMH 0.9335
147 4J8 0.9332
148 OAA 0.9331
149 52C 0.9330
150 GUA 0.9330
151 268 0.9326
152 MLT 0.9326
153 ABV 0.9325
154 AN3 0.9325
155 L99 0.9325
156 0W1 0.9324
157 URO 0.9324
158 03V 0.9324
159 2AQ 0.9324
160 PZI 0.9324
161 OGA 0.9323
162 HBA 0.9322
163 173 0.9322
164 NIZ 0.9319
165 SE2 0.9318
166 KTW 0.9318
167 4AA 0.9317
168 4LW 0.9317
169 4FS 0.9317
170 AMS 0.9316
171 EVF 0.9314
172 GAB 0.9314
173 FBB 0.9313
174 CH9 0.9312
175 TIU 0.9310
176 270 0.9309
177 MQN 0.9308
178 PRA 0.9300
179 4JQ 0.9300
180 ES5 0.9300
181 A5E 0.9298
182 P92 0.9297
183 6KT 0.9295
184 BEN 0.9293
185 5WV 0.9293
186 7VP 0.9289
187 NYL 0.9289
188 ET2 0.9289
189 3HB 0.9287
190 J9N 0.9286
191 9ZE 0.9285
192 SNO 0.9284
193 OCH 0.9283
194 HA5 0.9282
195 NCA 0.9282
196 F9P 0.9282
197 SAN 0.9279
198 1A7 0.9278
199 6RQ 0.9278
200 S2G 0.9276
201 259 0.9275
202 PEA 0.9275
203 SKM 0.9273
204 FBM 0.9272
205 PBC 0.9272
206 MAJ 0.9271
207 BHA 0.9270
208 3ID 0.9268
209 VNL 0.9266
210 J6W 0.9265
211 RAT 0.9264
212 GDE 0.9264
213 M45 0.9263
214 X0V 0.9261
215 4FH 0.9261
216 K2T 0.9257
217 4SX 0.9256
218 DYA 0.9255
219 IFP 0.9253
220 TGX 0.9252
221 YRL 0.9252
222 JG8 0.9252
223 4M0 0.9251
224 4VP 0.9251
225 258 0.9250
226 CXF 0.9245
227 ES2 0.9245
228 12T 0.9243
229 KTA 0.9243
230 DOB 0.9243
231 15E 0.9242
232 GJZ 0.9241
233 XM0 0.9240
234 2A9 0.9239
235 8XL 0.9238
236 AL0 0.9238
237 BAM 0.9238
238 EXD 0.9237
239 KOJ 0.9236
240 GO2 0.9236
241 FCR 0.9235
242 XQ0 0.9235
243 WCE 0.9234
244 F9Y 0.9231
245 4JT 0.9230
246 0TU 0.9230
247 2HG 0.9226
248 DE5 0.9223
249 AEF 0.9222
250 NCT 0.9221
251 FBS 0.9221
252 5CU 0.9220
253 AC0 0.9220
254 PJW 0.9219
255 3AB 0.9219
256 EKZ 0.9218
257 MR1 0.9216
258 RSO 0.9216
259 AAS 0.9214
260 JAE 0.9214
261 ODO 0.9214
262 069 0.9213
263 OVV 0.9210
264 NTN 0.9210
265 LMR 0.9206
266 P72 0.9205
267 I3E 0.9205
268 AOT 0.9204
269 1P8 0.9204
270 CLW 0.9203
271 4XR 0.9203
272 4CS 0.9203
273 ASC 0.9201
274 FAN 0.9199
275 36R 0.9197
276 4YO 0.9197
277 49F 0.9196
278 A29 0.9196
279 KTJ 0.9195
280 LDP 0.9194
281 H8N 0.9194
282 SRT 0.9193
283 CXP 0.9193
284 8WT 0.9193
285 2HQ 0.9192
286 4RU 0.9190
287 3HG 0.9187
288 N2I 0.9187
289 XYL 0.9184
290 RB5 0.9184
291 OK7 0.9184
292 AHR 0.9184
293 GZL 0.9183
294 YZM 0.9182
295 VGD 0.9181
296 MAH 0.9180
297 152 0.9180
298 7MU 0.9180
299 QSH 0.9178
300 M4S 0.9177
301 6PC 0.9175
302 NIO 0.9173
303 S7J 0.9172
304 XDK 0.9172
305 RNO 0.9169
306 KJU 0.9168
307 8GC 0.9168
308 KKN 0.9167
309 FUD 0.9166
310 4JM 0.9164
311 BNF 0.9161
312 LT2 0.9160
313 QWN 0.9160
314 KMH 0.9159
315 I1E 0.9158
316 S8V 0.9158
317 9FE 0.9158
318 53C 0.9157
319 CWJ 0.9156
320 DHI 0.9155
321 QMP 0.9154
322 3QM 0.9153
323 1L5 0.9153
324 GLC 0.9150
325 ASO 0.9147
326 3NT 0.9146
327 94W 0.9143
328 N2Z 0.9140
329 ES7 0.9140
330 92G 0.9138
331 GJP 0.9138
332 HX3 0.9138
333 JA8 0.9137
334 UNU 0.9136
335 11S 0.9135
336 FBF 0.9134
337 5VM 0.9134
338 L22 0.9133
339 NOJ 0.9133
340 5HN 0.9133
341 4JC 0.9132
342 0F9 0.9131
343 SHA 0.9125
344 14O 0.9125
345 BRT 0.9125
346 ONR 0.9124
347 9R5 0.9124
348 5NU 0.9123
349 86J 0.9123
350 ISN 0.9122
351 B85 0.9121
352 F60 0.9121
353 XCG 0.9120
354 TYE 0.9119
355 5RO 0.9119
356 GLU 0.9117
357 4V2 0.9117
358 6AI 0.9116
359 TMG 0.9116
360 OKG 0.9115
361 E7S 0.9114
362 NOY 0.9113
363 COI 0.9111
364 BEA 0.9111
365 R2P 0.9110
366 1Z6 0.9109
367 VGL 0.9109
368 RNS 0.9107
369 B40 0.9107
370 1HN 0.9106
371 5H1 0.9106
372 X0U 0.9104
373 DHK 0.9102
374 GGL 0.9100
375 SS1 0.9099
376 URS 0.9098
377 P80 0.9098
378 DBH 0.9098
379 NMJ 0.9097
380 5MB 0.9094
381 TT4 0.9092
382 FK1 0.9092
383 KDV 0.9091
384 FHC 0.9090
385 PH3 0.9089
386 7WG 0.9088
387 3HA 0.9087
388 ES9 0.9087
389 BPY 0.9086
390 BZX 0.9086
391 4NZ 0.9085
392 HFA 0.9084
393 2FT 0.9083
394 45L 0.9082
395 3AE 0.9082
396 HPS 0.9081
397 5MI 0.9081
398 ZYR 0.9081
399 PHE 0.9080
400 FGZ 0.9079
401 QXW 0.9076
402 3F0 0.9075
403 FP1 0.9074
404 M2K 0.9073
405 JND 0.9073
406 DGN 0.9072
407 IAC 0.9072
408 CTL 0.9072
409 YPN 0.9071
410 5GU 0.9071
411 DIN 0.9071
412 EN1 0.9068
413 BQ2 0.9066
414 BZE 0.9066
415 3BU 0.9065
416 ALE 0.9065
417 TH7 0.9065
418 VXX 0.9065
419 2FY 0.9064
420 4XV 0.9064
421 LPK 0.9063
422 YCP 0.9063
423 LR5 0.9060
424 HMH 0.9060
425 DGL 0.9059
426 TWO 0.9058
427 IF7 0.9058
428 I3A 0.9058
429 A7W 0.9057
430 14J 0.9057
431 GOJ 0.9055
432 S7A 0.9054
433 SYV 0.9054
434 KUF 0.9054
435 MS9 0.9053
436 3PG 0.9053
437 2K4 0.9053
438 S2P 0.9052
439 BGC 0.9051
440 TTL 0.9050
441 J9T 0.9050
442 3OC 0.9050
443 12Q 0.9048
444 3BZ 0.9046
445 RUY 0.9045
446 AEG 0.9045
447 HSO 0.9044
448 R9Y 0.9044
449 H4N 0.9043
450 SHI 0.9042
451 GAL 0.9041
452 OVM 0.9040
453 1SA 0.9040
454 HHH 0.9037
455 PZM 0.9037
456 5XB 0.9036
457 7W4 0.9034
458 ICO 0.9032
459 TAG 0.9031
460 8NX 0.9031
461 GWM 0.9030
462 GYE 0.9030
463 DAL DAL 0.9029
464 2F6 0.9026
465 HHA 0.9026
466 3MB 0.9026
467 8U3 0.9024
468 FBA 0.9024
469 XRG 0.9023
470 PZA 0.9023
471 27B 0.9022
472 8NB 0.9021
473 BNS 0.9020
474 NBZ 0.9019
475 39O 0.9018
476 FQI 0.9013
477 PQK 0.9012
478 N3W 0.9012
479 G2F 0.9011
480 2O6 0.9011
481 5RN 0.9011
482 SSC 0.9010
483 KBZ 0.9008
484 3M0 0.9008
485 X48 0.9008
486 N1E 0.9006
487 7W1 0.9005
488 1DW 0.9005
489 CWM 0.9002
490 EA1 0.9002
491 2AL 0.9001
492 0N7 0.9000
493 GLN 0.9000
494 AZ9 0.8999
495 HNK 0.8998
496 7N0 0.8997
497 ALA ALA 0.8997
498 4XF 0.8996
499 2QC 0.8996
500 DGJ 0.8995
501 XUL 0.8993
502 FA1 0.8993
503 E7Z 0.8992
504 QUZ 0.8992
505 CN0 0.8991
506 SKF 0.8990
507 GF4 0.8989
508 ES0 0.8988
509 IFL 0.8987
510 PBA 0.8986
511 A7N 0.8985
512 5QX 0.8985
513 OW4 0.8984
514 4LV 0.8983
515 KMY 0.8983
516 BE2 0.8983
517 NFA 0.8982
518 56D 0.8982
519 4JL 0.8982
520 4XS 0.8980
521 4Z4 0.8979
522 2CK 0.8979
523 SSB 0.8979
524 HDL 0.8977
525 1P7 0.8976
526 4HM 0.8972
527 EUG 0.8972
528 NPY 0.8971
529 JFJ 0.8969
530 N8Y 0.8968
531 ASP 0.8964
532 42J 0.8964
533 MEV 0.8961
534 F4K 0.8961
535 SAL 0.8960
536 FYU 0.8959
537 363 0.8959
538 UFV 0.8959
539 SVD 0.8958
540 4I8 0.8958
541 AJV 0.8957
542 BDP 0.8957
543 61M 0.8956
544 HQT 0.8956
545 MRW 0.8956
546 2BX 0.8955
547 Q88 0.8954
548 FF2 0.8953
549 QY9 0.8953
550 DHS 0.8952
551 IPB 0.8952
552 AM4 0.8952
553 NDH 0.8950
554 AX3 0.8949
555 HG3 0.8947
556 P7Y 0.8947
557 P9E 0.8947
558 JBK 0.8944
559 8OZ 0.8943
560 8H8 0.8943
561 DS0 0.8942
562 IV2 0.8942
563 82I 0.8942
564 HQD 0.8940
565 SKA 0.8940
566 RM1 0.8939
567 8NY 0.8938
568 CWS 0.8938
569 SME 0.8937
570 R8S 0.8936
571 PKU 0.8934
572 BP7 0.8933
573 HSM 0.8932
574 BZJ 0.8931
575 92P 0.8930
576 DHY 0.8929
577 FUM 0.8929
578 CXH 0.8928
579 92K 0.8927
580 Z5P 0.8926
581 C2B 0.8926
582 3R4 0.8925
583 0P6 0.8925
584 S0E 0.8922
585 KJH 0.8922
586 DNF 0.8922
587 6QF 0.8921
588 SD4 0.8919
589 2D0 0.8919
590 ORN 0.8918
591 67N 0.8918
592 261 0.8917
593 3XX 0.8916
594 SOR 0.8915
595 XLS 0.8914
596 F0J 0.8913
597 2FQ 0.8913
598 QSC 0.8912
599 D3G 0.8911
600 1PT 0.8911
601 LYL 0.8910
602 GVY 0.8907
603 AA 0.8907
604 A7H 0.8906
605 3VX 0.8906
606 505 0.8905
607 0VT 0.8905
608 APS 0.8904
609 JF6 0.8903
610 SEP 0.8900
611 GZ2 0.8900
612 XXG 0.8898
613 XAZ 0.8898
614 IT2 0.8898
615 1CO 0.8897
616 AJY 0.8897
617 5VL 0.8897
618 3DM 0.8896
619 XBT 0.8896
620 NF3 0.8895
621 4CM 0.8893
622 FBW 0.8892
623 DPN 0.8889
624 OHG 0.8889
625 1WC 0.8888
626 6M9 0.8888
627 P81 0.8887
628 R9S 0.8887
629 V55 0.8885
630 FZM 0.8884
631 FE DB1 0.8883
632 OEG 0.8882
633 B62 0.8882
634 GLO 0.8880
635 0FK 0.8880
636 3QV 0.8880
637 GTR 0.8880
638 PEY 0.8879
639 6ME 0.8879
640 TSS 0.8879
641 7MW 0.8878
642 KYA 0.8878
643 BE7 0.8877
644 FDR 0.8876
645 N91 0.8876
646 AY4 0.8876
647 ENO 0.8876
648 HX2 0.8875
649 TYR 0.8874
650 XDE 0.8874
651 8HC 0.8873
652 1P3 0.8872
653 4SV 0.8872
654 ZBT 0.8871
655 PXL 0.8871
656 PD2 0.8870
657 GLY GLY 0.8869
658 5B1 0.8869
659 PMB 0.8869
660 SIN 0.8868
661 AMC 0.8868
662 6FB 0.8867
663 7WV 0.8866
664 C2Y 0.8863
665 SOE 0.8863
666 H4E 0.8862
667 4M4 0.8859
668 M6W 0.8858
669 E4P 0.8857
670 795 0.8856
671 ZEC 0.8856
672 3SL 0.8856
673 JRB 0.8855
674 URC 0.8855
675 K5W 0.8855
676 8CM 0.8854
677 JKE 0.8852
678 0FN 0.8848
679 NAG 0.8846
680 NLE 0.8846
681 7O4 0.8846
682 PYF 0.8846
683 TAR 0.8845
684 RMN 0.8845
685 ES6 0.8842
686 ANC 0.8840
687 BP9 0.8838
688 GNM 0.8837
689 IOS 0.8837
690 AJ2 0.8837
691 ANF 0.8836
692 KT7 0.8836
693 3HP 0.8836
694 ADA 0.8835
695 PEL 0.8835
696 DQU 0.8835
697 DDU 0.8834
698 535 0.8834
699 M1A 0.8833
700 MET 0.8833
701 M6N 0.8833
702 M58 0.8831
703 51R 0.8829
704 CIT 0.8828
705 7BC 0.8827
706 FB2 0.8826
707 BTY 0.8825
708 5TY 0.8824
709 1X4 0.8824
710 XHP 0.8824
711 JBE 0.8824
712 M5K 0.8823
713 68A 0.8822
714 PEP 0.8822
715 4VY 0.8821
716 EUE 0.8821
717 3C4 0.8818
718 Q02 0.8817
719 44V 0.8817
720 RHU 0.8817
721 NSP 0.8815
722 OTW 0.8815
723 1DV 0.8814
724 K7M 0.8814
725 8W9 0.8814
726 0FO 0.8812
727 13P 0.8811
728 MNM 0.8811
729 M1Z 0.8810
730 4HP 0.8810
731 GZ3 0.8809
732 0NX 0.8808
733 ORO 0.8808
734 QIC 0.8806
735 3U4 0.8805
736 HMU 0.8805
737 1KP 0.8804
738 MXN 0.8803
739 OVP 0.8803
740 9RW 0.8803
741 8TX 0.8796
742 2EC 0.8796
743 G3F 0.8794
744 449 0.8793
745 PGH 0.8793
746 Y3L 0.8793
747 3IT 0.8792
748 VKC 0.8791
749 SMN 0.8791
750 TLA 0.8791
751 PRZ 0.8791
752 8K2 0.8790
753 4TU 0.8789
754 GTQ 0.8789
755 DHC 0.8789
756 DEE 0.8788
757 PMF 0.8786
758 CCU 0.8786
759 30G 0.8785
760 F05 0.8785
761 3W8 0.8784
762 344 0.8784
763 TTY 0.8784
764 44W 0.8783
765 1SQ 0.8783
766 B57 0.8781
767 FBJ 0.8780
768 0W8 0.8779
769 P3K 0.8776
770 2LP 0.8774
771 7WR 0.8774
772 1LQ 0.8774
773 4MU 0.8773
774 HBX 0.8773
775 QIV 0.8772
776 9EW 0.8772
777 2LY 0.8771
778 TEO 0.8769
779 5RG 0.8769
780 75K 0.8768
781 GCU 0.8767
782 M1Q 0.8767
783 0RW 0.8766
784 AHB 0.8764
785 2H5 0.8764
786 RA7 0.8763
787 LYS 0.8761
788 M5H 0.8761
789 KMT 0.8761
790 OQC 0.8761
791 C82 0.8760
792 LDU 0.8759
793 2FX 0.8759
794 J9W 0.8758
795 MEW 0.8758
796 1VK 0.8758
797 I4B 0.8755
798 Z13 0.8754
799 3FH 0.8754
800 JZ5 0.8754
801 MVN 0.8753
802 GAF 0.8752
803 3VS 0.8752
804 OXC 0.8752
805 SYN 0.8752
806 3Z8 0.8751
807 GXY 0.8750
808 M4E 0.8749
809 1NP 0.8748
810 OHP 0.8747
811 9TZ 0.8745
812 G3H 0.8744
813 R8V 0.8744
814 FLC 0.8744
815 YTX 0.8743
816 THA 0.8743
817 4HC 0.8741
818 LZM 0.8741
819 GBN 0.8739
820 Q24 0.8738
821 GLA 0.8738
822 AZ8 0.8738
823 1XA 0.8737
824 24W 0.8735
825 3AL 0.8733
826 LEU 0.8733
827 X6X 0.8732
828 2AK 0.8732
829 23A 0.8732
830 XCZ 0.8731
831 SWA 0.8731
832 5JQ 0.8731
833 7B4 0.8731
834 PCA 0.8730
835 JA5 0.8730
836 EGR 0.8730
837 EMZ 0.8730
838 4ME 0.8728
839 QX2 0.8727
840 PPT 0.8726
841 5JC 0.8726
842 DEN 0.8726
843 TH0 0.8725
844 650 0.8724
845 6M4 0.8722
846 1MC 0.8722
847 MUA 0.8722
848 AQO 0.8721
849 ZZT 0.8720
850 PDC 0.8719
851 PH2 0.8718
852 JBZ 0.8718
853 4HO 0.8718
854 PY7 0.8717
855 ABN 0.8717
856 PRO 0.8717
857 C21 0.8715
858 GIF 0.8714
859 24B 0.8714
860 AES 0.8714
861 GIV 0.8714
862 CK2 0.8713
863 42A 0.8711
864 APG 0.8711
865 B55 0.8706
866 QWW 0.8705
867 MCT 0.8704
868 FDB 0.8702
869 MZG 0.8702
870 JPZ 0.8701
871 GCS 0.8699
872 LVD 0.8699
873 PRF 0.8698
874 AGK 0.8697
875 1WD 0.8696
876 9BF 0.8695
877 DVQ 0.8695
878 PE0 0.8695
879 GP9 0.8694
880 E3X 0.8694
881 JP2 0.8692
882 H5B 0.8692
883 5M0 0.8692
884 JAH 0.8691
885 HHS 0.8691
886 RD4 0.8689
887 GXL 0.8689
888 QX4 0.8689
889 4AV 0.8688
890 80G 0.8688
891 5IQ 0.8688
892 2K8 0.8687
893 6GU 0.8687
894 N5J 0.8686
895 SR1 0.8684
896 54G 0.8682
897 SRO 0.8681
898 1GN 0.8681
899 BZI 0.8681
900 HH5 0.8680
901 27Y 0.8679
902 4YS 0.8678
903 LZ1 0.8678
904 HSE 0.8675
905 0V5 0.8674
906 2CQ 0.8674
907 IND 0.8672
908 XAN 0.8672
909 V1T 0.8671
910 4JU 0.8671
911 ES1 0.8670
912 8S0 0.8669
913 5Q0 0.8668
914 CEE 0.8667
915 5JL 0.8665
916 6CS 0.8665
917 BVA 0.8664
918 FH2 0.8663
919 5SG 0.8663
920 DX4 0.8663
921 MWJ 0.8663
922 5MH 0.8663
923 G3P 0.8662
924 FOA 0.8661
925 F2W 0.8660
926 SJ5 0.8659
927 MWP 0.8659
928 B1J 0.8659
929 5OO 0.8655
930 HLR 0.8652
931 86L 0.8651
932 4JJ 0.8651
933 FA3 0.8651
934 QBK 0.8651
935 SVN 0.8650
936 KW8 0.8647
937 KJY 0.8646
938 AW5 0.8646
939 5GT 0.8645
940 FBV 0.8645
941 N4E 0.8644
942 DOR 0.8643
943 F12 0.8643
944 6VD 0.8642
945 MXD 0.8642
946 3SK 0.8641
947 XXP 0.8639
948 149 0.8638
949 2FG 0.8638
950 GPJ 0.8637
951 UFO 0.8634
952 ADZ 0.8632
953 MZT 0.8631
954 R67 0.8630
955 6AP 0.8629
956 HHR 0.8627
957 XBZ 0.8627
958 VNJ 0.8627
959 EV0 0.8626
960 CTS 0.8625
961 FB1 0.8625
962 8G0 0.8624
963 0R0 0.8624
964 4P0 0.8623
965 PGA 0.8621
966 9KT 0.8618
967 7MX 0.8615
968 AMQ 0.8614
969 X11 0.8612
970 IDM 0.8611
971 A9P 0.8611
972 RIB 0.8610
973 BR9 0.8610
974 0XT 0.8610
975 209 0.8609
976 1DU 0.8609
977 4CL 0.8609
978 MWM 0.8608
979 DNA 0.8606
980 OMD 0.8606
981 MBG 0.8604
982 F1A 0.8604
983 URF 0.8604
984 JZ3 0.8602
985 TOF 0.8602
986 XYP 0.8601
987 4HB 0.8600
988 A13 0.8599
989 23J 0.8598
990 AAN 0.8597
991 36M 0.8595
992 A09 0.8595
993 FQX 0.8592
994 9UL 0.8590
995 XYD 0.8590
996 YH7 0.8590
997 6DP 0.8589
998 JZ2 0.8588
999 9YL 0.8587
1000 TDR 0.8586
1001 PSE 0.8582
1002 NM2 0.8582
1003 DBX 0.8582
1004 A1U 0.8582
1005 PQ0 0.8581
1006 4ZE 0.8580
1007 CCD 0.8577
1008 0CU 0.8575
1009 2AC 0.8572
1010 CLZ 0.8568
1011 IP8 0.8567
1012 DAV 0.8567
1013 E0O 0.8567
1014 5MK 0.8566
1015 ROI 0.8565
1016 HQY 0.8563
1017 2PG 0.8558
1018 9X7 0.8557
1019 NDG 0.8556
1020 3R6 0.8556
1021 275 0.8555
1022 ICP 0.8555
1023 SX1 0.8554
1024 KBB 0.8554
1025 KYN 0.8553
1026 X1S 0.8552
1027 DRL 0.8549
1028 34A 0.8548
1029 42C 0.8547
1030 BIK 0.8546
1031 0OC 0.8544
1032 APZ 0.8543
1033 JXN 0.8542
1034 Y8I 0.8539
1035 AKH 0.8538
1036 SYA 0.8537
1037 FBU 0.8536
1038 A5P 0.8534
1039 2MP 0.8533
1040 WBU 0.8532
1041 NID 0.8530
1042 MJ2 0.8530
1043 MD6 0.8528
1044 1XM 0.8525
1045 UY7 0.8523
1046 DPT 0.8514
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
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