Receptor
PDB id Resolution Class Description Source Keywords
5cbb 2.01 Å EC: 2.3.3.9 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS MALATE SYNTH COMPLEX WITH 5-(3H-INDOL-3-YLIDENE)-2,5-DIHYDRO-1H-PYRAZOLEC ARBOXYLATE MYCOBACTERIUM TUBERCULOSIS (STRAIN ATCH37RV) FRAGMENT COMPLEX 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
4ZF A:802;
 Valid;
 none;
 submit data
227.219 C12 H9 N3 O2 c1ccc...
MG A:801;
 Part of Protein;
 none;
 submit data
24.305 Mg [Mg+2...
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: 4ZF; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 4ZF 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 4ZF; Similar ligands found: 685
No: Ligand Similarity coefficient
1 5ER 0.9549
2 1XS 0.9523
3 NKI 0.9467
4 WG8 0.9449
5 RGK 0.9427
6 5VU 0.9418
7 3F4 0.9417
8 FC2 0.9416
9 SZ5 0.9414
10 WLH 0.9412
11 IDZ 0.9409
12 C4E 0.9379
13 20D 0.9373
14 LI7 0.9368
15 1V8 0.9362
16 DFL 0.9360
17 9JT 0.9346
18 1V1 0.9334
19 JCZ 0.9327
20 08C 0.9315
21 A63 0.9301
22 8M5 0.9295
23 MN QAY 0.9292
24 3D8 0.9278
25 A73 0.9277
26 25F 0.9275
27 272 0.9270
28 M83 0.9270
29 6DQ 0.9269
30 PJK 0.9268
31 1FL 0.9264
32 9CE 0.9263
33 Q5M 0.9259
34 27F 0.9258
35 JFS 0.9257
36 WA2 0.9255
37 S98 0.9253
38 H7S 0.9251
39 G2V 0.9248
40 2QU 0.9246
41 YE7 0.9242
42 Q2S 0.9241
43 MR4 0.9239
44 6BK 0.9227
45 F40 0.9227
46 L2K 0.9225
47 JSX 0.9224
48 4GU 0.9217
49 QUB 0.9215
50 6H2 0.9214
51 2WU 0.9210
52 HH6 0.9210
53 L5D 0.9208
54 P4T 0.9207
55 Q92 0.9206
56 1HP 0.9201
57 ZIP 0.9198
58 B21 0.9197
59 TRP 0.9196
60 LR2 0.9195
61 FY8 0.9195
62 EMU 0.9194
63 CX5 0.9192
64 AOY 0.9191
65 TJM 0.9182
66 1UZ 0.9182
67 NFZ 0.9179
68 G30 0.9178
69 53X 0.9174
70 28A 0.9173
71 97K 0.9172
72 833 0.9170
73 7L4 0.9170
74 CMG 0.9169
75 VT3 0.9168
76 ZEA 0.9165
77 H35 0.9164
78 H2W 0.9162
79 CDJ 0.9161
80 TVC 0.9161
81 0RY 0.9156
82 ZME 0.9154
83 5NN 0.9151
84 A5H 0.9148
85 BMC 0.9146
86 ARJ 0.9143
87 49P 0.9141
88 M3W 0.9138
89 91F 0.9138
90 TID 0.9135
91 LL1 0.9134
92 ADN 0.9133
93 F18 0.9133
94 2JX 0.9131
95 ZEZ 0.9130
96 5B2 0.9127
97 FCD 0.9126
98 U13 0.9126
99 KLS 0.9124
100 5TZ 0.9124
101 BXS 0.9123
102 W8L 0.9123
103 2P3 0.9122
104 1Q1 0.9117
105 1SF 0.9117
106 E9L 0.9115
107 U4J 0.9115
108 2PV 0.9111
109 1ZC 0.9110
110 Q0K 0.9110
111 0NJ 0.9107
112 5V7 0.9107
113 8BD 0.9105
114 4AU 0.9104
115 AVX 0.9100
116 AUV 0.9099
117 4K2 0.9098
118 NPZ 0.9097
119 ITE 0.9093
120 ASE 0.9093
121 5TU 0.9091
122 MR5 0.9091
123 YE6 0.9089
124 MBP 0.9089
125 FHV 0.9086
126 1KN 0.9085
127 UN9 0.9083
128 S1D 0.9083
129 2PK 0.9083
130 NDD 0.9082
131 GOE 0.9081
132 5WW 0.9080
133 PIQ 0.9079
134 3WK 0.9076
135 NOC 0.9075
136 MR6 0.9073
137 C0V 0.9073
138 1UT 0.9072
139 CG 0.9071
140 2J1 0.9070
141 26C 0.9070
142 338 0.9069
143 2QV 0.9069
144 BRY 0.9068
145 0K7 0.9068
146 B5A 0.9068
147 TCR 0.9065
148 5S9 0.9064
149 A05 0.9063
150 D9Z 0.9062
151 3SU 0.9061
152 0FR 0.9059
153 LI4 0.9059
154 ZRL 0.9057
155 5E5 0.9056
156 H75 0.9054
157 NZ4 0.9053
158 3GX 0.9052
159 47V 0.9052
160 1AJ 0.9051
161 4FC 0.9049
162 0UL 0.9048
163 ZRK 0.9046
164 X2M 0.9046
165 P4L 0.9045
166 5XL 0.9043
167 MHB 0.9042
168 4CN 0.9041
169 HRM 0.9041
170 6P3 0.9040
171 C09 0.9038
172 LU2 0.9038
173 CX6 0.9038
174 NAL 0.9036
175 ZZA 0.9034
176 HRD 0.9033
177 XIF XYP 0.9030
178 6QT 0.9030
179 IXM 0.9028
180 1V4 0.9027
181 GNG 0.9026
182 4Z9 0.9024
183 0DF 0.9023
184 1EB 0.9022
185 TIZ 0.9022
186 1V0 0.9020
187 XEV 0.9018
188 5FL 0.9016
189 2UD 0.9015
190 JF8 0.9014
191 7FZ 0.9012
192 1QP 0.9012
193 IQQ 0.9011
194 FYR 0.9010
195 II4 0.9010
196 S60 0.9008
197 OLU 0.9008
198 A5Q 0.9008
199 KU1 0.9008
200 5F8 0.9007
201 G14 0.9007
202 0SY 0.9007
203 MJW 0.9007
204 1FE 0.9007
205 QC1 0.9007
206 9OF 0.9006
207 BGU 0.9006
208 1V3 0.9005
209 3JC 0.9004
210 RUG 0.9003
211 IOP 0.9002
212 WA1 0.9002
213 0XR 0.9002
214 TH1 0.9001
215 M3F 0.9000
216 7EH 0.8999
217 TVZ 0.8998
218 LR8 0.8998
219 BX4 0.8996
220 8UY 0.8994
221 SSY 0.8992
222 AGI 0.8992
223 7LU 0.8992
224 EAT 0.8992
225 Q4G 0.8990
226 O53 0.8990
227 9BF 0.8990
228 A64 0.8990
229 1UR 0.8988
230 WDW 0.8987
231 GEN 0.8986
232 7G2 0.8984
233 103 0.8983
234 AVA 0.8982
235 DFV 0.8980
236 HWH 0.8980
237 0OP 0.8979
238 801 0.8979
239 QKU 0.8977
240 DXK 0.8977
241 EFX 0.8976
242 T21 0.8976
243 AUY 0.8975
244 Q9T 0.8975
245 1Q4 0.8975
246 B4L 0.8974
247 ESR 0.8971
248 XJ2 0.8971
249 6JM 0.8970
250 VBC 0.8969
251 XYP XYP 0.8968
252 6VW 0.8967
253 LUM 0.8965
254 3AK 0.8964
255 U14 0.8964
256 LOT 0.8964
257 K7H 0.8964
258 5SJ 0.8964
259 2GQ 0.8963
260 HNT 0.8962
261 4MP 0.8962
262 FBC 0.8960
263 JTF 0.8960
264 2UV 0.8959
265 4FF 0.8957
266 B1J 0.8956
267 JAH 0.8956
268 RVE 0.8955
269 IMK 0.8954
270 57D 0.8953
271 TIA 0.8953
272 RSV 0.8952
273 F36 0.8952
274 0OK 0.8952
275 28B 0.8951
276 C0H 0.8948
277 D87 0.8946
278 4NR 0.8944
279 UV4 0.8943
280 124 0.8943
281 S0D 0.8943
282 EQA 0.8943
283 XYS XYS 0.8940
284 A9B 0.8940
285 3D3 0.8938
286 68C 0.8937
287 C0W 0.8937
288 KLE 0.8936
289 ML1 0.8934
290 PQM 0.8934
291 ZHA 0.8932
292 4G2 0.8928
293 2D2 0.8927
294 11X 0.8926
295 SNV 0.8926
296 E9S 0.8926
297 3WO 0.8924
298 3VQ 0.8924
299 3WN 0.8924
300 1Q2 0.8924
301 245 0.8923
302 CBE 0.8921
303 FNT 0.8921
304 MQR 0.8919
305 IQW 0.8919
306 EST 0.8916
307 1R5 0.8916
308 XYP XIF 0.8914
309 NU3 0.8911
310 BMZ 0.8908
311 NE2 0.8908
312 M78 0.8906
313 3WL 0.8906
314 3Q0 0.8906
315 AV4 0.8905
316 JMG 0.8903
317 JVD 0.8903
318 NAR 0.8899
319 5HG 0.8899
320 122 0.8899
321 CR4 0.8899
322 RKY 0.8898
323 5C1 0.8897
324 5BX 0.8897
325 L1T 0.8897
326 108 0.8892
327 DDC 0.8892
328 EQU 0.8891
329 LWA 0.8890
330 5H6 0.8889
331 WCU 0.8888
332 6C8 0.8886
333 NW1 0.8883
334 BJ4 0.8883
335 3AD 0.8883
336 GVI 0.8881
337 135 0.8880
338 397 0.8880
339 SQM 0.8879
340 KW7 0.8879
341 KTM 0.8878
342 D64 0.8878
343 3TI 0.8875
344 6SD 0.8875
345 5WT 0.8875
346 ERZ 0.8874
347 AXX 0.8872
348 L03 0.8872
349 MQS 0.8872
350 8G6 0.8869
351 QIV 0.8869
352 9UL 0.8868
353 72D 0.8862
354 A51 0.8860
355 TPM 0.8860
356 FCW 0.8859
357 39Z 0.8859
358 4UM 0.8857
359 SDN 0.8857
360 LTN 0.8857
361 58N 0.8856
362 DE7 0.8856
363 0ON 0.8856
364 12R 0.8854
365 KWB 0.8854
366 FLF 0.8853
367 5TO 0.8853
368 NRA 0.8852
369 4YE 0.8851
370 38E 0.8850
371 XAV 0.8850
372 A6W 0.8850
373 MUX 0.8849
374 QUE 0.8849
375 CC5 0.8848
376 6C5 0.8848
377 LC1 0.8848
378 QR2 0.8848
379 PMM 0.8848
380 121 0.8845
381 CUE 0.8845
382 J1K 0.8844
383 X8I 0.8844
384 LZ5 0.8841
385 LJ2 0.8841
386 5AD 0.8840
387 5ZM 0.8840
388 DT7 0.8840
389 LLG 0.8840
390 BZC 0.8839
391 72E 0.8839
392 5WK 0.8839
393 PW5 0.8839
394 LJ1 0.8837
395 KLV 0.8837
396 XYS XYP 0.8835
397 5P3 0.8833
398 RCV 0.8833
399 29F 0.8833
400 8V8 0.8832
401 5P7 0.8832
402 MT6 0.8830
403 68B 0.8829
404 XYP XDN 0.8828
405 KWV 0.8828
406 0LA 0.8826
407 C9M 0.8825
408 FSE 0.8825
409 78Y 0.8824
410 XDN XYP 0.8824
411 0QA 0.8823
412 IPJ 0.8823
413 0DJ 0.8819
414 K0G 0.8818
415 E3X 0.8818
416 UN4 0.8817
417 AP6 0.8815
418 NQ7 0.8812
419 K80 0.8812
420 613 0.8812
421 IIH 0.8811
422 MRE 0.8811
423 120 0.8810
424 AJG 0.8809
425 X2L 0.8809
426 DL6 0.8807
427 GXD 0.8807
428 52F 0.8806
429 AZC 0.8805
430 PE2 0.8804
431 BSU 0.8802
432 6FX 0.8802
433 3IL 0.8802
434 5M2 0.8801
435 NIY 0.8800
436 CK2 0.8798
437 9F8 0.8798
438 BNY 0.8797
439 GN5 0.8796
440 CX4 0.8795
441 1DR 0.8795
442 AV6 0.8794
443 5TT 0.8793
444 RHN 0.8792
445 C53 0.8791
446 6MW 0.8790
447 AV7 0.8790
448 5WN 0.8790
449 CWE 0.8789
450 OUA 0.8788
451 XIL 0.8787
452 XCG 0.8787
453 XDL XYP 0.8786
454 4YF 0.8785
455 363 0.8785
456 8CC 0.8784
457 BVS 0.8783
458 20N 0.8782
459 SWX 0.8782
460 PRL 0.8782
461 EAE 0.8781
462 H4B 0.8780
463 EES 0.8780
464 IGP 0.8779
465 KMP 0.8779
466 XYP XIM 0.8778
467 4HB 0.8777
468 BBP 0.8776
469 5OR 0.8776
470 17M 0.8776
471 4BX 0.8773
472 7G0 0.8772
473 D25 0.8770
474 B2E 0.8769
475 6WU 0.8768
476 L22 0.8766
477 BIH 0.8765
478 ZTW 0.8763
479 6C9 0.8763
480 697 0.8762
481 0QV 0.8762
482 NYJ 0.8761
483 JF5 0.8761
484 J3Z 0.8760
485 C9E 0.8759
486 HFT 0.8758
487 0NX 0.8757
488 ODK 0.8756
489 BIO 0.8755
490 C0Y 0.8755
491 5SD 0.8755
492 S0A 0.8754
493 6FG 0.8753
494 90G 0.8753
495 DX2 0.8753
496 GHQ 0.8752
497 JCQ 0.8752
498 FZM 0.8752
499 R4E 0.8751
500 7FU 0.8750
501 LJ5 0.8750
502 E6Q 0.8750
503 06R 0.8748
504 VFJ 0.8746
505 6TJ 0.8746
506 6XC 0.8745
507 OA1 0.8745
508 2ZI 0.8745
509 QNM 0.8745
510 U12 0.8745
511 31F 0.8743
512 OJD 0.8743
513 FER 0.8742
514 SGW 0.8742
515 M4N 0.8740
516 9PP 0.8740
517 3N0 0.8740
518 AJ1 0.8739
519 IY5 0.8739
520 4V2 0.8739
521 79W 0.8739
522 N1E 0.8738
523 18E 0.8737
524 GZV 0.8736
525 VM1 0.8736
526 JMM 0.8735
527 72G 0.8734
528 YZ9 0.8733
529 QS4 0.8733
530 SU9 0.8732
531 XTS 0.8728
532 DRG 0.8727
533 0X2 0.8727
534 JGB 0.8726
535 1HR 0.8726
536 55D 0.8725
537 FTK 0.8725
538 8D6 0.8725
539 DHT 0.8725
540 JNW 0.8725
541 TES 0.8723
542 6C4 0.8723
543 ZYC 0.8722
544 802 0.8722
545 4L2 0.8722
546 NIF 0.8721
547 IRH 0.8721
548 T5J 0.8718
549 N5B 0.8718
550 LMZ 0.8718
551 GJB 0.8718
552 SNP 0.8717
553 Z3R 0.8717
554 J45 0.8715
555 W2E 0.8715
556 TFX 0.8712
557 BP7 0.8712
558 VC3 0.8711
559 XZ1 0.8710
560 Y3L 0.8710
561 41L 0.8709
562 DQH 0.8708
563 HPX 0.8708
564 NXB 0.8705
565 GXG 0.8704
566 6B5 0.8702
567 F63 0.8701
568 DTR 0.8699
569 L15 0.8698
570 AQN 0.8697
571 3L1 0.8694
572 FF2 0.8694
573 78P 0.8692
574 40N 0.8692
575 BZM 0.8691
576 6GP 0.8691
577 HBI 0.8690
578 NQ8 0.8690
579 A26 0.8690
580 196 0.8690
581 TMG 0.8689
582 S7P 0.8689
583 H0V 0.8688
584 BHS 0.8686
585 6FB 0.8685
586 HWB 0.8684
587 C1E 0.8683
588 041 0.8682
589 IQZ 0.8682
590 27K 0.8681
591 6F3 0.8680
592 581 0.8679
593 5CX 0.8678
594 DAH 0.8676
595 5DE 0.8673
596 SNJ 0.8672
597 H2B 0.8671
598 DX6 0.8670
599 5EZ 0.8668
600 IK1 0.8668
601 MFR 0.8667
602 J38 0.8665
603 X48 0.8662
604 CHQ 0.8660
605 GLA BEZ 0.8659
606 BQ2 0.8659
607 S7S 0.8658
608 M5H 0.8656
609 ZSP 0.8655
610 LZ7 0.8654
611 6J3 0.8653
612 78U 0.8653
613 OX2 0.8653
614 J8D 0.8648
615 5WS 0.8645
616 5XM 0.8639
617 GJG 0.8638
618 6EN 0.8633
619 IS2 0.8632
620 5TY 0.8631
621 7ZO 0.8630
622 GB4 0.8628
623 N0Z 0.8627
624 4Z1 0.8622
625 DHC 0.8622
626 B7H 0.8622
627 PQV 0.8621
628 STL 0.8620
629 RDT 0.8620
630 PUE 0.8619
631 7GP 0.8619
632 R18 0.8617
633 OCZ 0.8617
634 92O 0.8614
635 F0C 0.8613
636 SNR 0.8612
637 IW4 0.8612
638 OA4 0.8611
639 3VS 0.8607
640 L07 0.8607
641 FMH 0.8606
642 VM7 0.8602
643 0MB 0.8602
644 S8G 0.8601
645 F08 0.8600
646 TRP GLY 0.8600
647 P7V 0.8599
648 QUG 0.8598
649 0LO 0.8594
650 FQX 0.8593
651 NK5 0.8593
652 DX8 0.8592
653 6DH 0.8591
654 WV7 0.8589
655 3CX 0.8587
656 72H 0.8587
657 907 0.8585
658 88X 0.8582
659 3K1 0.8580
660 MHD GAL 0.8579
661 7ZL 0.8578
662 D8Q 0.8577
663 RAY 0.8574
664 GVY 0.8573
665 SAK 0.8570
666 GAT 0.8564
667 PNJ 0.8563
668 EZL 0.8562
669 9KZ 0.8558
670 GJK 0.8556
671 HPK 0.8555
672 AON 0.8551
673 147 0.8551
674 JBB 0.8550
675 GO2 0.8543
676 PNW 0.8542
677 0H5 0.8540
678 M5A 0.8536
679 6ZW 0.8533
680 334 0.8533
681 OUG 0.8532
682 V2Z 0.8527
683 AH3 0.8520
684 ANB 0.8518
685 55H 0.8508
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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