Receptor
PDB id Resolution Class Description Source Keywords
1BGG 2.3 Å EC: 3.2.1.21 GLUCOSIDASE A FROM BACILLUS POLYMYXA COMPLEXED WITH GLUCONAT PAENIBACILLUS POLYMYXA FAMILY 1 BETA-GLUCOSIDASE COMPLEX GLYCOSYL-HYDROLASE COMPLE
Ref.: CRYSTAL STRUCTURE OF BETA-GLUCOSIDASE A FROM BACILL POLYMYXA: INSIGHTS INTO THE CATALYTIC ACTIVITY IN F GLYCOSYL HYDROLASES. J.MOL.BIOL. V. 275 491 1998
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GCO B:500;
C:500;
D:500;
 Valid;
Valid;
Valid;
 none;
none;
none;
 submit data
196.155 C6 H12 O7 C([C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6R4K 2.13 Å EC: 3.2.1.21 STRUCTURE OF BETA-GLUCOSIDASE A FROM PAENIBACILLUS POLYMYXA WITH A MONOVALENT INHIBITOR PAENIBACILLUS POLYMYXA HYDROLASE BETA-GLUCOSIDASE GLYCOSIDASE CARBOHYDRATE CARBMETABOLISM POLISACCHARIDE DEGRADATION COMPLEX INHIBITOR
Ref.: STRUCTURAL BASIS OF THE INHIBITION OF GH1 BETA-GLUC BY MULTIVALENT PYRROLIDINE IMINOSUGARS. BIOORG.CHEM. V. 89 03026 2019
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 25 families.
1 1UYQ - NFG C12 H13 F N2 O9 c1cc(c(cc1....
2 1BGG - GCO C6 H12 O7 C([C@H]([C....
3 6R4K Ki = 51 uM JSK C17 H25 N7 O4 [H]/N=N/NC....
4 1E4I - NFG C12 H13 F N2 O9 c1cc(c(cc1....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 1UYQ - NFG C12 H13 F N2 O9 c1cc(c(cc1....
2 1BGG - GCO C6 H12 O7 C([C@H]([C....
3 6R4K Ki = 51 uM JSK C17 H25 N7 O4 [H]/N=N/NC....
4 1E4I - NFG C12 H13 F N2 O9 c1cc(c(cc1....
50% Homology Family (89)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1W9D ic50 = 0.58 mM SEH C10 H13 N O4 S2 CCS/C(=NOS....
2 1W9B ic50 = 0.99 mM CGT C15 H21 N O8 S2 c1ccc(cc1)....
3 1E6Q Ki = 0.7 mM NTZ C6 H10 N4 O4 C([C@@H]1[....
4 1E70 - G2F C6 H11 F O5 C([C@@H]1[....
5 1E71 - ASC C6 H8 O6 C([C@@H]([....
6 2WXD ic50 = 3.3 uM E18 C12 H18 N2 O4 S2 CN(C)CCS/C....
7 1E72 Ki = 0.6 mM GOX C6 H12 N2 O5 C([C@@H]1[....
8 1E6X - LGC C6 H10 O6 C([C@@H]1[....
9 1E73 - ASC C6 H8 O6 C([C@@H]([....
10 1E6S Ki = 0.6 mM GOX C6 H12 N2 O5 C([C@@H]1[....
11 1BGG - GCO C6 H12 O7 C([C@H]([C....
12 6R4K Ki = 51 uM JSK C17 H25 N7 O4 [H]/N=N/NC....
13 1E4I - NFG C12 H13 F N2 O9 c1cc(c(cc1....
14 4EK7 - BGC C6 H12 O6 C([C@@H]1[....
15 3U57 - DH8 C27 H34 N2 O8 C/C=C/1[C@....
16 3U5Y - SCG C17 H24 O10 COC(=O)C1=....
17 5OKK - BGP C6 H13 O9 P C([C@@H]1[....
18 5OKE - BG6 C6 H13 O9 P C([C@@H]1[....
19 5OKR - BG6 C6 H13 O9 P C([C@@H]1[....
20 5OKG - BG6 C6 H13 O9 P C([C@@H]1[....
21 5OKQ - BGP C6 H13 O9 P C([C@@H]1[....
22 5OKS - BG6 C6 H13 O9 P C([C@@H]1[....
23 2ZOX - OLA C18 H34 O2 CCCCCCCCC=....
24 2E9M - OLA C18 H34 O2 CCCCCCCCC=....
25 2E9L - OLA C18 H34 O2 CCCCCCCCC=....
26 3AI0 - PNW C12 H15 N O8 c1cc(ccc1[....
27 4IPN - SGC RTG n/a n/a
28 5N6T - 8P2 C7 H11 N2 O4 C([C@@H]1[....
29 2WBG Ki = 35.2 uM LGS C15 H28 N2 O5 CCCCCCCC/N....
30 2J7H Kd = 65 nM AZF C5 H12 N2 O3 C1[C@H]([C....
31 2J7D Kd = 74 nM GI1 C10 H17 N2 O6 CO[C@@H](c....
32 1W3J Kd = 484 nM OXZ C5 H11 N O4 C1[C@H]([C....
33 2J7C Ki = 10.7 nM IDE C15 H19 N3 O4 c1ccc(cc1)....
34 2J79 Kd = 1.1 uM GTL C6 H12 N2 O5 C([C@@H]1[....
35 2WC3 Ki = 0.83 uM AM3 C15 H28 N2 O5 CCCCCCCC/N....
36 2J75 - NOY C6 H13 N O4 C1[C@@H]([....
37 2VRJ Kd = 0.5 uM NCW C15 H28 N2 O4 S CCCCCCCCNC....
38 2J7F Kd = 445 nM GI3 C9 H13 N2 O6 c1c([nH]c2....
39 2J77 Kd = 12.9 uM NOJ C6 H13 N O4 C1[C@@H]([....
40 5OSS Kd = 28.3 uM AEZ C8 H12 N2 O4 c1[nH]c2c(....
41 1UZ1 Ki = 130 nM IFL C6 H11 N O4 C1[C@@H]([....
42 2CBU Kd = 2.1 uM CTS C8 H15 N O4 C1C[N@]2C[....
43 2J7G Kd = 100 nM GI4 C10 H15 N2 O6 c1c([nH]c2....
44 5N6S - 8P5 C13 H23 N4 O5 C(CCN=[N+]....
45 2WC4 Kd = 5.1 uM AMF C15 H28 N2 O4 S CCCCCCCCN=....
46 2CBV Kd = 3.3 uM CGB C7 H13 N O4 C1C[C@]2([....
47 1OIF Ka = 51450000 M^-1 IFM C6 H13 N O3 C1[C@@H]([....
48 2CES Kd = 56 nM GIM C8 H13 N2 O4 c1c[n+]2c(....
49 2J7E Kd = 48 nM GI2 C11 H17 N2 O6 COC(=O)Cc1....
50 2J78 Kd = 384 nM GOX C6 H12 N2 O5 C([C@@H]1[....
51 1OIM Ka = 210000 M^-1 NOJ C6 H13 N O4 C1[C@@H]([....
52 2CET Kd = 9.6 nM PGI C16 H21 N2 O4 c1ccc(cc1)....
53 2J7B Kd = 240 nM NTZ C6 H10 N4 O4 C([C@@H]1[....
54 4JIE - BMA C6 H12 O6 C([C@@H]1[....
55 3AIV - HBO C9 H9 N O5 COc1ccc2c(....
56 3AIQ - HBO C9 H9 N O5 COc1ccc2c(....
57 3AIR - DNF C6 H4 N2 O5 c1cc(c(cc1....
58 3AIS - HBK BGC n/a n/a
59 3AIW - DNF C6 H4 N2 O5 c1cc(c(cc1....
60 4PTX - BGC C6 H12 O6 C([C@@H]1[....
61 4PTV - SGC BGC n/a n/a
62 3GNP - SOG C14 H28 O5 S CCCCCCCCS[....
63 6RJM - GLC C6 H12 O6 C([C@@H]1[....
64 6RK2 - 6GR C13 H16 O8 c1ccc(c(c1....
65 6RJO - SA0 C13 H18 O7 c1ccc(c(c1....
66 5AYI - BGC C6 H12 O6 C([C@@H]1[....
67 1E56 - BGC HBO n/a n/a
68 1E55 Ki = 76 uM DHR C8 H7 N O2 c1cc(ccc1[....
69 1V08 Ki ~ 1 uM NTZ C6 H10 N4 O4 C([C@@H]1[....
70 1E4N - HBO C9 H9 N O5 COc1ccc2c(....
71 1H49 - HBO BGC n/a n/a
72 5GNX - BGC C6 H12 O6 C([C@@H]1[....
73 5GNY - BGC C6 H12 O6 C([C@@H]1[....
74 5GNZ - BGC C6 H12 O6 C([C@@H]1[....
75 2E40 - LGC C6 H10 O6 C([C@@H]1[....
76 3F5K Ki = 0.024 mM BGC BGC BGC BGC BGC n/a n/a
77 7BZM - GIM C8 H13 N2 O4 c1c[n+]2c(....
78 4QLL Ka = 2400 M^-1 BGC BGC BGC BGC n/a n/a
79 4QLJ - BGC BGC BGC BGC n/a n/a
80 3F5J Ki = 0.052 mM BGC BGC BGC BGC n/a n/a
81 4QLK Ka = 1800 M^-1 BGC BGC BGC BGC n/a n/a
82 3F5L Ki = 0.191 mM BGC BGC n/a n/a
83 3PTQ - NFG C12 H13 F N2 O9 c1cc(c(cc1....
84 4PBG - BGP C6 H13 O9 P C([C@@H]1[....
85 3CMJ - SRT C4 H6 O6 [C@H]([C@H....
86 5YIF - 8VR C9 H14 O8 C[C@]1(OC[....
87 1V03 - BGC CCN IPH n/a n/a
88 2O9T - BGC C6 H12 O6 C([C@@H]1[....
89 2O9R Ki = 21 mM SGC BGC n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GCO; Similar ligands found: 16
No: Ligand ECFP6 Tc MDL keys Tc
1 GCO 1 1
2 CS2 1 1
3 LG6 0.5 0.6
4 6PG 0.5 0.6
5 SOR 0.48 0.869565
6 MTL 0.48 0.869565
7 LFC 0.451613 0.608696
8 SDD 0.411765 0.913043
9 TAG 0.411765 0.913043
10 FUD 0.411765 0.913043
11 LPK 0.411765 0.913043
12 PSJ 0.411765 0.913043
13 SOL 0.411765 0.913043
14 QDK 0.40625 0.875
15 RBL 0.40625 0.875
16 XUL 0.40625 0.875
Similar Ligands (3D)
Ligand no: 1; Ligand: GCO; Similar ligands found: 1198
No: Ligand Similarity coefficient
1 LLH 0.9828
2 GLO 0.9688
3 FIX 0.9543
4 M74 0.9410
5 GTL 0.9393
6 KDG 0.9384
7 DXG 0.9373
8 GAL 0.9356
9 G8M 0.9343
10 RAT 0.9335
11 REL 0.9332
12 R2P 0.9301
13 XYH 0.9296
14 6KT 0.9292
15 2FG 0.9285
16 GTR 0.9264
17 HFA 0.9262
18 149 0.9253
19 GAF 0.9252
20 DEE 0.9252
21 1GN 0.9250
22 N9J 0.9248
23 GO2 0.9247
24 LGT 0.9240
25 3BU 0.9240
26 GLR 0.9239
27 GAE 0.9235
28 GLA 0.9233
29 BGC 0.9230
30 XEN 0.9220
31 AKG 0.9218
32 7MW 0.9215
33 2H5 0.9214
34 152 0.9213
35 EMZ 0.9211
36 3YP 0.9203
37 M5E 0.9199
38 RMN 0.9194
39 DER 0.9192
40 92K 0.9187
41 GLU 0.9187
42 7D2 0.9177
43 GRO 0.9173
44 HIS 0.9172
45 NVU 0.9171
46 GLC 0.9170
47 PPY 0.9165
48 AOS 0.9164
49 OGA 0.9162
50 XLS 0.9148
51 3MF 0.9147
52 MBG 0.9146
53 LX1 0.9144
54 PHE 0.9144
55 NCT 0.9135
56 2QC 0.9135
57 5OB 0.9132
58 YIO 0.9126
59 MSR 0.9126
60 XYL 0.9120
61 A29 0.9119
62 2UB 0.9119
63 DEW 0.9117
64 5XC 0.9116
65 A5E 0.9113
66 8OZ 0.9112
67 TYR 0.9112
68 DAL DAL 0.9111
69 15L 0.9107
70 CPZ 0.9107
71 36Y 0.9107
72 ISA 0.9102
73 PDC 0.9101
74 BZ3 0.9097
75 PSV 0.9095
76 HX4 0.9094
77 TX4 0.9091
78 HDL 0.9090
79 URO 0.9088
80 0N7 0.9088
81 9SE 0.9084
82 AZ9 0.9081
83 S0E 0.9080
84 3PG 0.9078
85 23J 0.9075
86 HHH 0.9075
87 UN1 0.9073
88 GCB 0.9072
89 URC 0.9070
90 3LR 0.9069
91 DA3 0.9069
92 42A 0.9068
93 C5A 0.9067
94 6XI 0.9067
95 2D8 0.9065
96 I3A 0.9064
97 OOG 0.9064
98 5XB 0.9064
99 BCU 0.9061
100 EN1 0.9061
101 EA1 0.9060
102 DZA 0.9060
103 AL0 0.9060
104 GOX 0.9059
105 LY0 0.9058
106 LZM 0.9056
107 ADA 0.9055
108 EVA 0.9054
109 ASC 0.9053
110 ENO 0.9051
111 1L5 0.9051
112 AZM 0.9050
113 7HQ 0.9049
114 1F1 0.9048
115 56D 0.9043
116 0HO 0.9043
117 6NT 0.9043
118 5RP 0.9040
119 0HN 0.9039
120 2ZM 0.9035
121 CTS 0.9034
122 HC4 0.9034
123 4I8 0.9033
124 A3M 0.9030
125 5GU 0.9029
126 JZA 0.9029
127 C9E 0.9028
128 8ZE 0.9028
129 BZJ 0.9027
130 7OD 0.9026
131 3NY 0.9026
132 KPA 0.9025
133 TAR 0.9024
134 5UK 0.9024
135 DHI 0.9024
136 TMG 0.9024
137 FA1 0.9023
138 BPY 0.9023
139 LGC 0.9022
140 PD2 0.9021
141 INO 0.9020
142 GLN 0.9020
143 HPP 0.9019
144 HQJ 0.9019
145 ICO 0.9018
146 SHI 0.9017
147 DHK 0.9017
148 7UC 0.9015
149 JDN 0.9015
150 TYL 0.9015
151 PIM 0.9015
152 JB5 0.9014
153 AHC 0.9013
154 LKA 0.9012
155 03V 0.9009
156 Q88 0.9009
157 I38 0.9008
158 KUF 0.9007
159 61M 0.9007
160 5NI 0.9006
161 MMN 0.9006
162 41K 0.9005
163 HCI 0.9005
164 PPT 0.9004
165 HQD 0.9003
166 IWT 0.9002
167 PO6 0.9000
168 QIC 0.8999
169 SNU 0.8999
170 42C 0.8998
171 DTY 0.8998
172 3A9 0.8997
173 BDP 0.8995
174 JRB 0.8995
175 X6X 0.8994
176 DGN 0.8993
177 ES5 0.8992
178 6NI 0.8992
179 4MU 0.8991
180 5RN 0.8990
181 8S0 0.8989
182 J0Z 0.8989
183 BZ2 0.8988
184 92P 0.8987
185 CWS 0.8986
186 APG 0.8986
187 2FY 0.8985
188 XAN 0.8985
189 4LW 0.8985
190 4ME 0.8984
191 DGL 0.8984
192 0JD 0.8984
193 OMD 0.8984
194 NK1 0.8983
195 XI7 0.8983
196 X48 0.8983
197 PCS 0.8982
198 COU 0.8981
199 4FS 0.8980
200 SHA 0.8979
201 RNO 0.8979
202 P7Y 0.8977
203 15N 0.8976
204 173 0.8975
205 JB8 0.8975
206 MAH 0.8974
207 JAW 0.8974
208 7NI 0.8973
209 RQD 0.8973
210 46P 0.8972
211 Q6T 0.8971
212 4HC 0.8971
213 MAJ 0.8970
214 RUY 0.8970
215 S2P 0.8969
216 8WQ 0.8968
217 HHI 0.8968
218 GDE 0.8968
219 J6W 0.8968
220 1P7 0.8966
221 ESX 0.8966
222 SNO 0.8966
223 XQG 0.8965
224 TRP 0.8965
225 1Z6 0.8965
226 FOC 0.8964
227 6FZ 0.8963
228 MES 0.8962
229 TLM 0.8962
230 97T 0.8961
231 VNL 0.8961
232 HA7 0.8961
233 HG3 0.8960
234 8TX 0.8959
235 2HG 0.8959
236 XDK 0.8959
237 DYT 0.8958
238 IOS 0.8958
239 HNK 0.8958
240 BNL 0.8958
241 B3U 0.8957
242 BZQ 0.8957
243 F9Y 0.8955
244 S0W 0.8955
245 6DP 0.8954
246 AKH 0.8953
247 4RW 0.8953
248 SYM 0.8953
249 R20 0.8953
250 PBA 0.8952
251 DPN 0.8952
252 92G 0.8952
253 CXP 0.8951
254 APZ 0.8950
255 2AQ 0.8949
256 0A9 0.8949
257 9UL 0.8949
258 7BC 0.8948
259 PRZ 0.8948
260 QUS 0.8947
261 TYE 0.8947
262 GNL 0.8946
263 NSG 0.8946
264 ICT 0.8946
265 OCH 0.8945
266 GTK 0.8945
267 QBK 0.8945
268 HL4 0.8944
269 SSC 0.8944
270 ABI 0.8944
271 0QW 0.8944
272 7O4 0.8944
273 C2Y 0.8943
274 9RW 0.8943
275 CCB 0.8942
276 S2G 0.8942
277 EVF 0.8942
278 SQ4 0.8942
279 RNS 0.8941
280 R9S 0.8941
281 0P6 0.8940
282 8CM 0.8939
283 SKM 0.8939
284 GVG 0.8939
285 JTH 0.8938
286 IF7 0.8938
287 UAN 0.8938
288 3CR 0.8937
289 069 0.8937
290 NNO 0.8936
291 ES0 0.8934
292 ALE 0.8934
293 5B1 0.8933
294 44V 0.8933
295 KMH 0.8933
296 EXD 0.8933
297 N8Y 0.8932
298 DIR 0.8932
299 GTQ 0.8932
300 3VW 0.8932
301 2ZQ 0.8932
302 ISD 0.8932
303 KTA 0.8932
304 6LW 0.8931
305 4TB 0.8929
306 FHC 0.8929
307 EUE 0.8929
308 DHB 0.8928
309 1VK 0.8928
310 4PN 0.8928
311 F4E 0.8928
312 A7W 0.8927
313 FA0 0.8927
314 ESP 0.8927
315 SQ7 0.8927
316 091 0.8926
317 4LV 0.8926
318 PMF 0.8926
319 DGJ 0.8925
320 7C3 0.8925
321 SD4 0.8925
322 NDH 0.8924
323 2LY 0.8923
324 M4E 0.8923
325 JF6 0.8923
326 E1P 0.8923
327 OW7 0.8923
328 5WY 0.8922
329 AOT 0.8922
330 M1E 0.8921
331 F31 0.8921
332 5CU 0.8921
333 MR1 0.8920
334 75K 0.8920
335 0OY 0.8920
336 5RG 0.8920
337 L13 0.8920
338 MS9 0.8920
339 BTY 0.8919
340 52C 0.8919
341 8XL 0.8919
342 2O6 0.8919
343 4NC 0.8918
344 HJH 0.8918
345 CWM 0.8917
346 4A3 0.8917
347 B09 0.8917
348 RNT 0.8916
349 5QY 0.8916
350 AZG 0.8916
351 LNO 0.8916
352 DHY 0.8916
353 36E 0.8916
354 2F6 0.8915
355 7VS 0.8914
356 J9W 0.8914
357 BEA 0.8913
358 5M0 0.8913
359 NF3 0.8913
360 7WR 0.8912
361 ICB 0.8912
362 FCB 0.8911
363 E4P 0.8911
364 A2F 0.8911
365 FDK 0.8911
366 3HG 0.8911
367 L5V 0.8911
368 1BN 0.8910
369 54G 0.8910
370 LL2 0.8909
371 XRX 0.8908
372 4M0 0.8908
373 0F9 0.8908
374 HF2 0.8908
375 ZON 0.8907
376 MWP 0.8907
377 4WL 0.8907
378 FA3 0.8906
379 HA5 0.8906
380 CXH 0.8906
381 8GL 0.8906
382 3IT 0.8905
383 3TC 0.8905
384 8VN 0.8904
385 3QO 0.8904
386 B55 0.8903
387 DIN 0.8903
388 HDH 0.8903
389 DQA 0.8902
390 MRW 0.8902
391 6AP 0.8902
392 EUG 0.8901
393 2HQ 0.8900
394 TSR 0.8899
395 2C2 0.8898
396 9ZE 0.8897
397 GBN 0.8897
398 HYA 0.8897
399 MEV 0.8897
400 H42 0.8896
401 2HO 0.8896
402 FK8 0.8896
403 FHB 0.8895
404 5RO 0.8895
405 D5X 0.8895
406 KYN 0.8895
407 MJ5 0.8895
408 M0Q 0.8894
409 F12 0.8894
410 J9Q 0.8894
411 YH7 0.8894
412 SYA 0.8893
413 Z5P 0.8893
414 Q07 0.8893
415 HMS 0.8892
416 PJW 0.8892
417 QPR 0.8891
418 SMN 0.8891
419 PBN 0.8891
420 ARG 0.8891
421 ESI 0.8890
422 N2I 0.8889
423 LDP 0.8889
424 7MK 0.8889
425 ALL 0.8888
426 NID 0.8888
427 L22 0.8887
428 7ME 0.8886
429 JQ5 0.8886
430 DOB 0.8886
431 P80 0.8885
432 HNL 0.8885
433 CTL 0.8884
434 HIC 0.8884
435 GGB 0.8884
436 TT4 0.8884
437 DE5 0.8884
438 OA3 0.8882
439 RM1 0.8882
440 2HC 0.8880
441 MYJ 0.8880
442 XIZ 0.8880
443 LTT 0.8880
444 TTY 0.8879
445 L99 0.8879
446 3HP 0.8879
447 GUA 0.8879
448 PAC 0.8878
449 AH8 0.8877
450 CFI 0.8877
451 ONR 0.8877
452 EYV 0.8877
453 7ZE 0.8876
454 5NU 0.8876
455 HPV 0.8876
456 GZL 0.8875
457 9R5 0.8875
458 XIY 0.8875
459 2HU 0.8874
460 36M 0.8874
461 DBX 0.8873
462 7QS 0.8873
463 DHC 0.8873
464 6GU 0.8872
465 1WC 0.8872
466 NFA 0.8871
467 MQB 0.8871
468 AZ8 0.8870
469 1A7 0.8870
470 4V2 0.8870
471 9DG 0.8869
472 9FL 0.8869
473 N4E 0.8869
474 TL5 0.8869
475 XAZ 0.8868
476 1XA 0.8868
477 9TZ 0.8867
478 5MB 0.8866
479 2D0 0.8866
480 RES 0.8866
481 8WO 0.8866
482 TIH 0.8865
483 SEP 0.8865
484 TZF 0.8865
485 12Q 0.8864
486 EGV 0.8864
487 4HP 0.8864
488 3HM 0.8863
489 0CU 0.8863
490 93K 0.8863
491 4OG 0.8863
492 Q24 0.8862
493 263 0.8862
494 5MI 0.8861
495 3AL 0.8861
496 14O 0.8860
497 P58 0.8860
498 GCS 0.8860
499 PHU 0.8860
500 BK9 0.8859
501 8SZ 0.8859
502 40F 0.8858
503 SRO 0.8858
504 G3F 0.8857
505 6TZ 0.8857
506 RB5 0.8856
507 APS 0.8856
508 6AI 0.8856
509 E0O 0.8856
510 PE0 0.8855
511 8WT 0.8855
512 CIT 0.8855
513 HSO 0.8855
514 A9P 0.8854
515 FB1 0.8854
516 M4T 0.8854
517 DXP 0.8853
518 FLC 0.8853
519 OHP 0.8853
520 HLZ 0.8852
521 JLZ 0.8852
522 AJ2 0.8852
523 E79 0.8852
524 RJY 0.8852
525 B62 0.8851
526 AQO 0.8851
527 54Z 0.8851
528 RLG 0.8851
529 G3E 0.8850
530 DNF 0.8849
531 4HM 0.8849
532 LNR 0.8849
533 0NX 0.8849
534 ES9 0.8848
535 E7Z 0.8848
536 KYA 0.8848
537 CUW 0.8848
538 ISZ 0.8848
539 0OL 0.8848
540 ALA ALA 0.8847
541 M1Q 0.8847
542 SQV 0.8847
543 MVH 0.8847
544 JPZ 0.8846
545 5WZ 0.8846
546 45L 0.8845
547 CH8 0.8845
548 5QX 0.8844
549 E8U 0.8844
550 NCD 0.8844
551 5H1 0.8843
552 N5J 0.8843
553 GUN 0.8843
554 F69 0.8843
555 4TP 0.8843
556 PNZ 0.8843
557 F4K 0.8842
558 F60 0.8841
559 EDR 0.8841
560 NIZ 0.8841
561 AZA 0.8840
562 SG3 0.8840
563 KTJ 0.8840
564 11S 0.8839
565 DX4 0.8839
566 BZX 0.8839
567 2AL 0.8839
568 9FE 0.8839
569 4VY 0.8838
570 86J 0.8838
571 EYJ 0.8838
572 LFR 0.8838
573 IAC 0.8838
574 HH5 0.8838
575 1M2 0.8838
576 9PY 0.8837
577 FUL 0.8837
578 HGA 0.8837
579 463 0.8837
580 1LQ 0.8836
581 GYE 0.8835
582 IV2 0.8835
583 HL5 0.8835
584 3FH 0.8835
585 2LP 0.8834
586 5MK 0.8833
587 M45 0.8833
588 BHU 0.8833
589 4YS 0.8832
590 BCK 0.8832
591 GLY GLY GLY 0.8832
592 FDB 0.8831
593 1SQ 0.8831
594 1Z8 0.8831
595 9J3 0.8830
596 AFS 0.8830
597 QMS 0.8829
598 IGA 0.8827
599 1AL 0.8827
600 TCA 0.8826
601 M0W 0.8825
602 9W5 0.8825
603 AFR 0.8824
604 5WV 0.8824
605 2AS 0.8824
606 2K4 0.8823
607 ES1 0.8823
608 EOL 0.8823
609 9KT 0.8823
610 B41 0.8823
611 AEG 0.8823
612 BHA 0.8822
613 M5K 0.8822
614 24W 0.8822
615 RM4 0.8822
616 141 0.8821
617 2BX 0.8821
618 8NB 0.8821
619 7MX 0.8821
620 7W1 0.8820
621 4XV 0.8820
622 J9T 0.8820
623 2FT 0.8820
624 SVD 0.8819
625 SRT 0.8819
626 27K 0.8819
627 SE2 0.8818
628 K6H 0.8818
629 TZM 0.8818
630 GCU 0.8818
631 HSX 0.8818
632 S7G 0.8816
633 YOF 0.8816
634 5SG 0.8815
635 86L 0.8815
636 OW4 0.8815
637 2BG 0.8814
638 ARP 0.8814
639 AHB 0.8814
640 MEW 0.8813
641 X05 0.8813
642 3HA 0.8813
643 PH3 0.8813
644 7VP 0.8812
645 M1Z 0.8812
646 CFP 0.8811
647 5JQ 0.8811
648 P4F 0.8810
649 6VD 0.8809
650 Q02 0.8809
651 5FN 0.8808
652 ODO 0.8808
653 KBB 0.8807
654 PEY 0.8806
655 SYV 0.8806
656 6J5 0.8806
657 DHS 0.8806
658 DMJ 0.8805
659 FP1 0.8805
660 CFA 0.8805
661 F90 0.8805
662 FBV 0.8804
663 FEH 0.8804
664 INE 0.8804
665 5Q0 0.8804
666 CCE 0.8804
667 JF1 0.8804
668 SXS 0.8803
669 5FX 0.8803
670 Q06 0.8803
671 8U3 0.8802
672 TIU 0.8801
673 3ID 0.8800
674 V55 0.8799
675 4JQ 0.8799
676 ET2 0.8798
677 5IQ 0.8798
678 K5W 0.8798
679 AMQ 0.8798
680 67N 0.8797
681 SAF 0.8797
682 CH9 0.8797
683 94W 0.8797
684 3PF 0.8796
685 FA6 0.8795
686 M6Z 0.8795
687 209 0.8794
688 EYK 0.8794
689 B40 0.8794
690 V6F 0.8793
691 4JT 0.8793
692 4TU 0.8793
693 6JN 0.8792
694 0A1 0.8792
695 T9G 0.8792
696 MCO 0.8791
697 9MG 0.8791
698 X0V 0.8791
699 M6H 0.8791
700 AX3 0.8791
701 N8P 0.8790
702 IFL 0.8789
703 J5I 0.8789
704 R9M 0.8789
705 9ON 0.8789
706 7A3 0.8789
707 RXA 0.8788
708 290 0.8788
709 VOH 0.8787
710 M72 0.8787
711 AAN 0.8787
712 HJ7 0.8787
713 11C 0.8786
714 RA7 0.8786
715 P9P 0.8785
716 9BF 0.8785
717 1FD 0.8784
718 D3G 0.8784
719 BM3 0.8784
720 KDV 0.8783
721 M1H 0.8783
722 DII 0.8783
723 5WX 0.8783
724 0FK 0.8783
725 K7M 0.8782
726 1XM 0.8780
727 I1E 0.8780
728 PYQ 0.8780
729 AMH 0.8780
730 HQT 0.8779
731 8IG 0.8777
732 HQ9 0.8777
733 2IT 0.8776
734 LYS 0.8776
735 3C4 0.8776
736 KTW 0.8776
737 6M4 0.8775
738 GV9 0.8775
739 NOJ 0.8775
740 IFP 0.8774
741 FGZ 0.8774
742 LRH 0.8774
743 BRH 0.8774
744 4AA 0.8774
745 OVM 0.8774
746 KOJ 0.8773
747 HQY 0.8773
748 B0D 0.8773
749 9TW 0.8773
750 DEZ 0.8773
751 FOT 0.8772
752 8G0 0.8772
753 YIE 0.8772
754 PRO GLY 0.8771
755 B57 0.8770
756 DOR 0.8770
757 BOA 0.8770
758 2EC 0.8770
759 LVD 0.8770
760 6FG 0.8770
761 C53 0.8770
762 UNC 0.8769
763 7MU 0.8769
764 49O 0.8769
765 ATX 0.8769
766 GWM 0.8769
767 3SL 0.8769
768 8EW 0.8768
769 GGL 0.8768
770 BHO 0.8768
771 5DL 0.8768
772 CHB 0.8767
773 QY9 0.8767
774 BDF 0.8767
775 PEP 0.8767
776 3M0 0.8767
777 P9E 0.8767
778 15E 0.8767
779 4P5 0.8767
780 1NP 0.8766
781 KJU 0.8766
782 KDF 0.8765
783 M5H 0.8765
784 11X 0.8765
785 BPW 0.8765
786 E1T 0.8764
787 LT2 0.8764
788 K6V 0.8764
789 0V5 0.8764
790 ORO 0.8763
791 6W6 0.8763
792 SHG 0.8762
793 IHB 0.8762
794 BPN 0.8761
795 3WA 0.8759
796 BL0 0.8759
797 GVM 0.8758
798 X1R 0.8758
799 J9N 0.8758
800 6MW 0.8757
801 S7S 0.8757
802 HXY 0.8757
803 BP7 0.8757
804 M3H 0.8756
805 MO8 0.8756
806 TSS 0.8756
807 39U 0.8756
808 YTX 0.8756
809 3F0 0.8755
810 H7Y 0.8755
811 N3W 0.8755
812 HPS 0.8755
813 BVA 0.8755
814 ENV 0.8754
815 QSH 0.8754
816 YZM 0.8754
817 SBK 0.8754
818 261 0.8753
819 6HO 0.8753
820 PZI 0.8753
821 X8Z 0.8753
822 EKZ 0.8752
823 OCA 0.8752
824 DBH 0.8751
825 BSA 0.8751
826 F0J 0.8750
827 HJP 0.8749
828 5LD 0.8749
829 1H1 0.8749
830 HHA 0.8749
831 BNF 0.8749
832 2CZ 0.8748
833 IOP 0.8748
834 VXX 0.8748
835 B2Y 0.8748
836 5JL 0.8747
837 1QP 0.8746
838 PH2 0.8746
839 FE DB1 0.8745
840 SLC 0.8745
841 KBG 0.8745
842 FPL 0.8744
843 4YO 0.8744
844 JND 0.8743
845 JF2 0.8743
846 4XF 0.8743
847 CIR 0.8743
848 3RK 0.8742
849 DIE 0.8742
850 4NM 0.8740
851 X6P 0.8740
852 OVP 0.8740
853 K4V 0.8739
854 R5P 0.8737
855 GTZ 0.8736
856 FBM 0.8736
857 N2Z 0.8736
858 HBO 0.8735
859 6J9 0.8735
860 9VQ 0.8735
861 HX8 0.8735
862 MAN 0.8735
863 H33 0.8734
864 TEP 0.8734
865 NGT 0.8734
866 3DM 0.8732
867 TWO 0.8732
868 OTR 0.8732
869 QMP 0.8732
870 7W4 0.8731
871 PFF 0.8731
872 DMD 0.8730
873 EXO 0.8730
874 YSO 0.8730
875 ISC 0.8730
876 51R 0.8729
877 ITW 0.8728
878 DLT 0.8728
879 LSA 0.8728
880 X09 0.8727
881 PUE 0.8727
882 3AB 0.8727
883 FF3 0.8726
884 3R6 0.8726
885 9RH 0.8725
886 GLY GLY 0.8725
887 S8V 0.8724
888 OAF 0.8724
889 S24 0.8723
890 RUJ 0.8723
891 QSB 0.8723
892 SAL 0.8723
893 GZQ 0.8723
894 M1A 0.8722
895 EHM 0.8722
896 SKF 0.8722
897 BQ2 0.8722
898 MXN 0.8721
899 4P0 0.8721
900 DTR 0.8721
901 STX 0.8720
902 UA5 0.8720
903 HNH 0.8720
904 MNP 0.8720
905 LMR 0.8720
906 BE2 0.8719
907 YPN 0.8719
908 0W8 0.8719
909 GXL 0.8718
910 PHI 0.8718
911 GF4 0.8718
912 GZ2 0.8718
913 NQ 0.8717
914 GJZ 0.8717
915 CFF 0.8716
916 1U6 0.8716
917 SDF 0.8716
918 MHO 0.8716
919 AHR 0.8715
920 CWJ 0.8715
921 4XS 0.8714
922 AHN 0.8714
923 HBU 0.8713
924 AT3 0.8712
925 UFV 0.8711
926 HNQ 0.8711
927 SLS 0.8710
928 4SX 0.8710
929 DJN 0.8710
930 8GK 0.8709
931 H4E 0.8709
932 BHH 0.8709
933 5NS 0.8708
934 LXP 0.8708
935 D2G 0.8708
936 ISN 0.8707
937 1SV 0.8707
938 0L1 0.8706
939 Q03 0.8706
940 FOM 0.8706
941 1P8 0.8706
942 PXL 0.8705
943 269 0.8705
944 13P 0.8705
945 6CS 0.8704
946 7Q1 0.8704
947 URS 0.8704
948 ONH 0.8703
949 DHQ 0.8702
950 ZGL 0.8701
951 SR4 0.8701
952 I2E 0.8700
953 Q9Z 0.8700
954 NGO 0.8699
955 27L 0.8699
956 DNC 0.8698
957 3MB 0.8698
958 TNX 0.8698
959 5ZZ 0.8698
960 293 0.8696
961 OA1 0.8695
962 S7A 0.8695
963 BCP 0.8694
964 M2K 0.8694
965 9CA 0.8693
966 VK3 0.8693
967 0LH 0.8693
968 JKE 0.8693
969 MZT 0.8693
970 RD4 0.8693
971 J4K 0.8692
972 D1X 0.8692
973 SOE 0.8692
974 R9J 0.8691
975 W81 0.8691
976 1IT 0.8690
977 TGX 0.8690
978 QX4 0.8690
979 SYC 0.8690
980 2SX 0.8689
981 OKG 0.8687
982 MUA 0.8687
983 DI6 0.8686
984 HIO 0.8685
985 8XQ 0.8685
986 4FH 0.8684
987 329 0.8684
988 2NP 0.8684
989 6R8 0.8684
990 PFB 0.8683
991 DE3 0.8683
992 1KH 0.8682
993 7N0 0.8682
994 ONL 0.8682
995 TPO 0.8682
996 C1M 0.8682
997 MHK 0.8681
998 NK2 0.8679
999 A9O 0.8679
1000 0BP 0.8679
1001 A13 0.8679
1002 ES2 0.8678
1003 268 0.8678
1004 1PS 0.8678
1005 RPQ 0.8677
1006 0OC 0.8676
1007 PIY 0.8675
1008 DHM 0.8675
1009 JFJ 0.8675
1010 OXC 0.8674
1011 1X4 0.8674
1012 PFL 0.8674
1013 88L 0.8674
1014 PGH 0.8674
1015 5SP 0.8673
1016 BMA 0.8672
1017 DAH 0.8671
1018 4BF 0.8671
1019 3PO 0.8671
1020 ETV 0.8671
1021 XXG 0.8670
1022 OAA 0.8670
1023 7B4 0.8669
1024 7Y3 0.8668
1025 2PG 0.8668
1026 XSP 0.8668
1027 R1P 0.8668
1028 BTM 0.8667
1029 IYR 0.8667
1030 3HB 0.8665
1031 DQU 0.8665
1032 3U4 0.8664
1033 SF6 0.8664
1034 TLA 0.8664
1035 XDE 0.8663
1036 GJP 0.8663
1037 LYL 0.8662
1038 4FP 0.8662
1039 AEH 0.8656
1040 3NT 0.8656
1041 ZZZ 0.8656
1042 1P3 0.8655
1043 RP3 0.8655
1044 3QM 0.8653
1045 IFG 0.8653
1046 NDM 0.8652
1047 DHZ 0.8651
1048 0W1 0.8651
1049 5DS 0.8650
1050 F9P 0.8650
1051 SPV 0.8649
1052 FBT 0.8649
1053 KIA 0.8648
1054 MMS 0.8648
1055 XYP 0.8648
1056 NYL 0.8647
1057 4BZ 0.8647
1058 F05 0.8646
1059 4AV 0.8646
1060 7A2 0.8646
1061 GAB 0.8645
1062 8W9 0.8645
1063 SME 0.8644
1064 X1P 0.8644
1065 TL6 0.8644
1066 7I2 0.8643
1067 AMG 0.8642
1068 GCW 0.8641
1069 ZME 0.8641
1070 NGW 0.8640
1071 M44 0.8640
1072 G6D 0.8640
1073 DAR 0.8639
1074 EE8 0.8639
1075 4RU 0.8639
1076 Z70 0.8638
1077 ILO 0.8638
1078 ASP 0.8638
1079 791 0.8637
1080 NWH 0.8637
1081 ASN 0.8636
1082 ZB1 0.8636
1083 ASP SER 0.8635
1084 CN0 0.8635
1085 PRF 0.8634
1086 A5P 0.8634
1087 WOO 0.8632
1088 7QD 0.8632
1089 BSX 0.8631
1090 ZWZ 0.8631
1091 KGK 0.8629
1092 SKG 0.8628
1093 S8D 0.8628
1094 258 0.8628
1095 R9Y 0.8628
1096 5VL 0.8627
1097 8NX 0.8627
1098 53C 0.8626
1099 XRS 0.8626
1100 78U 0.8625
1101 GRQ 0.8625
1102 FBU 0.8625
1103 4SV 0.8623
1104 MB1 0.8622
1105 CLZ 0.8622
1106 FLV 0.8621
1107 4KL 0.8620
1108 4XR 0.8619
1109 XX3 0.8619
1110 3MG 0.8618
1111 MSL 0.8618
1112 ORN 0.8617
1113 HX3 0.8616
1114 XCZ 0.8615
1115 9GB 0.8614
1116 E5X 0.8614
1117 1CO 0.8613
1118 ABF 0.8613
1119 HMU 0.8613
1120 LZ2 0.8612
1121 3SK 0.8612
1122 OVV 0.8611
1123 MUC 0.8611
1124 DX3 0.8611
1125 INS 0.8610
1126 HHR 0.8610
1127 HPA 0.8609
1128 FAN 0.8607
1129 R67 0.8606
1130 FYU 0.8606
1131 AVI 0.8604
1132 QBM 0.8604
1133 GIM 0.8603
1134 ES6 0.8601
1135 DDU 0.8601
1136 ZXD 0.8601
1137 2C0 0.8600
1138 LSQ 0.8600
1139 IXW 0.8600
1140 LT3 0.8599
1141 XXP 0.8599
1142 AEF 0.8597
1143 4A5 0.8596
1144 B53 0.8595
1145 HNM 0.8594
1146 MVL 0.8593
1147 3Z8 0.8592
1148 2CK 0.8592
1149 PQ0 0.8591
1150 FTV 0.8590
1151 BTE 0.8590
1152 PPR 0.8588
1153 R8V 0.8584
1154 AP4 0.8584
1155 LCN 0.8583
1156 717 0.8583
1157 ZYR 0.8580
1158 1GP 0.8580
1159 0MK 0.8579
1160 UFO 0.8578
1161 G2F 0.8577
1162 OIA 0.8577
1163 CK2 0.8573
1164 PRA 0.8571
1165 FUC 0.8570
1166 848 0.8569
1167 FCA 0.8568
1168 NBB 0.8568
1169 C2U 0.8566
1170 4CS 0.8565
1171 OEG 0.8565
1172 JR2 0.8563
1173 EPR 0.8562
1174 PEZ 0.8561
1175 FBW 0.8561
1176 PEQ 0.8558
1177 MLT 0.8557
1178 NMJ 0.8557
1179 M3Q 0.8557
1180 GIF 0.8556
1181 PQK 0.8554
1182 49N 0.8553
1183 CLU 0.8550
1184 LT1 0.8549
1185 8H8 0.8545
1186 505 0.8545
1187 LEU 0.8544
1188 EQW 0.8544
1189 K17 0.8541
1190 LL1 0.8538
1191 XM0 0.8538
1192 6F0 0.8536
1193 7HP 0.8532
1194 NPA 0.8530
1195 I4B 0.8530
1196 TTL 0.8520
1197 55D 0.8513
1198 JXN 0.8503
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 6r4k.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 6r4k.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 6r4k.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 6r4k.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 6r4k.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 6r4k.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 6r4k.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 6R4K; Ligand: JSK; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 6r4k.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback