Receptor
PDB id Resolution Class Description Source Keywords
3UWV 2.07 Å EC: 5.3.1.1 CRYSTAL STRUCTURE OF STAPHYLOCOCCUS AUREUS TRIOSEPHOSPHATE I COMPLEXED WITH 2-PHOSPHOGLYCERIC ACID STAPHYLOCOCCUS AUREUS TIM BARREL ISOMERASE
Ref.: CRYSTAL STRUCTURES OF TRIOSEPHOSPHATE ISOMERASE FRO METHICILLIN RESISTANT STAPHYLOCOCCUS AUREUS MRSA252 STRUCTURAL INSIGHTS INTO NOVEL MODES OF LIGAND BIND UNIQUE CONFORMATIONS OF CATALYTIC LOOP BIOCHIMIE V. 94 2532 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
2PG A:254;
B:255;
Valid;
Valid;
none;
none;
submit data
186.057 C3 H7 O7 P C([C@...
NA A:255;
A:256;
B:254;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3UWV 2.07 Å EC: 5.3.1.1 CRYSTAL STRUCTURE OF STAPHYLOCOCCUS AUREUS TRIOSEPHOSPHATE I COMPLEXED WITH 2-PHOSPHOGLYCERIC ACID STAPHYLOCOCCUS AUREUS TIM BARREL ISOMERASE
Ref.: CRYSTAL STRUCTURES OF TRIOSEPHOSPHATE ISOMERASE FRO METHICILLIN RESISTANT STAPHYLOCOCCUS AUREUS MRSA252 STRUCTURAL INSIGHTS INTO NOVEL MODES OF LIGAND BIND UNIQUE CONFORMATIONS OF CATALYTIC LOOP BIOCHIMIE V. 94 2532 2012
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 18 families.
1 3UWV - 2PG C3 H7 O7 P C([C@H](C(....
2 3UWW - 3PG C3 H7 O7 P C([C@H](C(....
3 3UWZ - G2H C3 H9 O6 P C(C(CO)OP(....
4 3M9Y - CIT C6 H8 O7 C(C(=O)O)C....
5 3UWU - G3P C3 H9 O6 P C([C@H](CO....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 9 families.
1 2BTM - PGA C2 H5 O6 P C(C(=O)O)O....
2 3UWV - 2PG C3 H7 O7 P C([C@H](C(....
3 3UWW - 3PG C3 H7 O7 P C([C@H](C(....
4 3UWZ - G2H C3 H9 O6 P C(C(CO)OP(....
5 3M9Y - CIT C6 H8 O7 C(C(=O)O)C....
6 3UWU - G3P C3 H9 O6 P C([C@H](CO....
50% Homology Family (68)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1IIH Ki = 1.3 mM 3PG C3 H7 O7 P C([C@H](C(....
2 2X1T - RES C4 H10 N O8 P C([C@H]([C....
3 5I3K Ki = 12 uM PGA C2 H5 O6 P C(C(=O)O)O....
4 2VEL - PGA C2 H5 O6 P C(C(=O)O)O....
5 5I3I Ki = 2.6 mM PGA C2 H5 O6 P C(C(=O)O)O....
6 2V2C Ki = 0.39 mM PGA C2 H5 O6 P C(C(=O)O)O....
7 2VEN - CIT C6 H8 O7 C(C(=O)O)C....
8 5I3H Ki = 120 uM PGA C2 H5 O6 P C(C(=O)O)O....
9 2X1S - X1S C3 H6 O5 S C(CS(=O)(=....
10 1KV5 Ki = 60 uM PGA C2 H5 O6 P C(C(=O)O)O....
11 4TIM Ki = 6.9 mM 2PG C3 H7 O7 P C([C@H](C(....
12 1TTJ - PGH C2 H6 N O6 P C(C(=O)NO)....
13 6TIM Ki = 0.61 mM G3P C3 H9 O6 P C([C@H](CO....
14 1TRD Ki = 4 uM PGH C2 H6 N O6 P C(C(=O)NO)....
15 2VEK - CIT C6 H8 O7 C(C(=O)O)C....
16 2V2H Ki = 0.17 mM PGA C2 H5 O6 P C(C(=O)O)O....
17 2J27 Ki = 0.3 mM PGA C2 H5 O6 P C(C(=O)O)O....
18 4PC8 - GOA C2 H4 O3 C(C(=O)O)O
19 2X1R - X1R C6 H12 O4 S CCCS(=O)(=....
20 2X2G - 3PG C3 H7 O7 P C([C@H](C(....
21 1TTI - PGA C2 H5 O6 P C(C(=O)O)O....
22 6UP5 - PGA C2 H5 O6 P C(C(=O)O)O....
23 6UPF - PGA C2 H5 O6 P C(C(=O)O)O....
24 1NF0 - 13P C3 H7 O6 P C(C(=O)COP....
25 7TIM - PGH C2 H6 N O6 P C(C(=O)NO)....
26 2YPI Ki = 15 uM PGA C2 H5 O6 P C(C(=O)O)O....
27 1NEY - 13P C3 H7 O6 P C(C(=O)COP....
28 2BTM - PGA C2 H5 O6 P C(C(=O)O)O....
29 5EYW - PGA C2 H5 O6 P C(C(=O)O)O....
30 6NEE - PGH C2 H6 N O6 P C(C(=O)NO)....
31 4YMZ - 13P C3 H7 O6 P C(C(=O)COP....
32 3UWV - 2PG C3 H7 O7 P C([C@H](C(....
33 3UWW - 3PG C3 H7 O7 P C([C@H](C(....
34 3UWZ - G2H C3 H9 O6 P C(C(CO)OP(....
35 3M9Y - CIT C6 H8 O7 C(C(=O)O)C....
36 3UWU - G3P C3 H9 O6 P C([C@H](CO....
37 1LYX Ki = 0.029 mM PGA C2 H5 O6 P C(C(=O)O)O....
38 1O5X - 3PY C3 H4 O4 C(C(=O)C(=....
39 2VFH - 3PG C3 H7 O7 P C([C@H](C(....
40 1M7O - 3PG C3 H7 O7 P C([C@H](C(....
41 2VFE - 3PG C3 H7 O7 P C([C@H](C(....
42 2VFI Ki = 1.9 mM 3PG C3 H7 O7 P C([C@H](C(....
43 1M7P - G3H C3 H7 O6 P C([C@H](C=....
44 3PVF - PGA C2 H5 O6 P C(C(=O)O)O....
45 2VFG - 3PG C3 H7 O7 P C([C@H](C(....
46 3TAO Kd = 7.28 uM PGH C2 H6 N O6 P C(C(=O)NO)....
47 1SUX - BTS C10 H11 N O3 S3 c1ccc2c(c1....
48 1TPW Ki = 0.5 mM PGH C2 H6 N O6 P C(C(=O)NO)....
49 1SW3 - PGA C2 H5 O6 P C(C(=O)O)O....
50 1TPB - PGH C2 H6 N O6 P C(C(=O)NO)....
51 1SW0 - PGA C2 H5 O6 P C(C(=O)O)O....
52 1TPH - PGH C2 H6 N O6 P C(C(=O)NO)....
53 1TPU - PGH C2 H6 N O6 P C(C(=O)NO)....
54 1TPV - PGH C2 H6 N O6 P C(C(=O)NO)....
55 1SW7 - PGA C2 H5 O6 P C(C(=O)O)O....
56 1TPC - PGH C2 H6 N O6 P C(C(=O)NO)....
57 2VXN - PGA C2 H5 O6 P C(C(=O)O)O....
58 2Y62 - G3P C3 H9 O6 P C([C@H](CO....
59 1AMK Ki = 0.05 mM PGA C2 H5 O6 P C(C(=O)O)O....
60 2Y61 - G3P C3 H9 O6 P C([C@H](CO....
61 1QDS Ki = 0.048 mM PGA C2 H5 O6 P C(C(=O)O)O....
62 1N55 - PGA C2 H5 O6 P C(C(=O)O)O....
63 1IF2 - 129 C3 H8 N O5 P C(CP(=O)(O....
64 6OOI - PGA C2 H5 O6 P C(C(=O)O)O....
65 6BVE - PGA C2 H5 O6 P C(C(=O)O)O....
66 4BI6 Kd = 113.3 uM PGA C2 H5 O6 P C(C(=O)O)O....
67 4BI7 Kd = 26.4 uM PGA C2 H5 O6 P C(C(=O)O)O....
68 6OOG - PGA C2 H5 O6 P C(C(=O)O)O....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 2PG; Similar ligands found: 9
No: Ligand ECFP6 Tc MDL keys Tc
1 2PG 1 1
2 PEZ 0.642857 0.8
3 DG2 0.5625 0.939394
4 PEQ 0.482759 0.705882
5 0V5 0.482759 0.705882
6 G2H 0.481481 0.882353
7 XSP 0.451613 0.757576
8 036 0.439024 0.810811
9 035 0.439024 0.810811
Similar Ligands (3D)
Ligand no: 1; Ligand: 2PG; Similar ligands found: 946
No: Ligand Similarity coefficient
1 PGA 1.0000
2 PEP 0.9722
3 3PG 0.9635
4 MLE 0.9577
5 PMB 0.9545
6 GZ3 0.9534
7 3SL 0.9518
8 PPR 0.9508
9 R67 0.9445
10 A13 0.9439
11 XCZ 0.9436
12 FB2 0.9429
13 DS0 0.9407
14 51R 0.9401
15 7N0 0.9398
16 FB1 0.9396
17 QMP 0.9394
18 RMN 0.9384
19 CDV 0.9378
20 PAC 0.9378
21 DCO 0.9377
22 SPV 0.9374
23 GLN 0.9372
24 FBV 0.9363
25 OSE 0.9360
26 K5W 0.9354
27 1GP 0.9349
28 QY9 0.9349
29 NFQ 0.9346
30 ASN 0.9341
31 SEP 0.9340
32 OHP 0.9340
33 OEM 0.9337
34 GRO 0.9337
35 ASP 0.9336
36 PZI 0.9323
37 MJ2 0.9321
38 HPS 0.9316
39 FBW 0.9315
40 AL0 0.9310
41 EDR 0.9300
42 ORO 0.9289
43 E4P 0.9286
44 LEU 0.9285
45 TPA 0.9283
46 23J 0.9281
47 2AL 0.9275
48 HL5 0.9270
49 PHU 0.9269
50 FBU 0.9268
51 DHK 0.9266
52 FBM 0.9260
53 EKZ 0.9256
54 DGL 0.9253
55 GP9 0.9250
56 F9P 0.9248
57 PMF 0.9244
58 JYD 0.9243
59 BHO 0.9243
60 FEH 0.9242
61 G3P 0.9241
62 G3H 0.9241
63 D1X 0.9241
64 5RG 0.9241
65 MLT 0.9239
66 PSE 0.9237
67 13P 0.9235
68 SVD 0.9231
69 GLU 0.9229
70 LMR 0.9219
71 DOR 0.9215
72 ISZ 0.9215
73 RSO 0.9211
74 AKG 0.9209
75 GTQ 0.9203
76 TSU 0.9203
77 UFV 0.9203
78 3FH 0.9194
79 9ON 0.9186
80 3OC 0.9185
81 4J8 0.9184
82 CIZ 0.9183
83 ALA ALA 0.9181
84 SC2 0.9178
85 I4B 0.9176
86 IPM 0.9175
87 X0V 0.9173
88 KVP 0.9172
89 5M0 0.9168
90 LLQ 0.9166
91 173 0.9164
92 OAA 0.9160
93 FBS 0.9158
94 BE2 0.9152
95 CMS 0.9151
96 PRZ 0.9149
97 GAB 0.9147
98 SAN 0.9147
99 FA3 0.9143
100 IFP 0.9142
101 152 0.9141
102 R9S 0.9140
103 8EW 0.9140
104 JKE 0.9139
105 URQ 0.9139
106 3LR 0.9137
107 DGN 0.9137
108 3NT 0.9137
109 COI 0.9135
110 CFI 0.9131
111 KDF 0.9129
112 SPA 0.9126
113 N8P 0.9126
114 4FH 0.9125
115 54G 0.9125
116 CRN 0.9124
117 BEZ 0.9124
118 BEN 0.9124
119 6PC 0.9123
120 KBB 0.9120
121 SS1 0.9119
122 P22 0.9117
123 34D 0.9117
124 A09 0.9116
125 ICF 0.9116
126 SYC 0.9113
127 RHU 0.9111
128 AAS 0.9111
129 6OT 0.9107
130 FRU 0.9101
131 GDE 0.9098
132 MYJ 0.9097
133 FCR 0.9097
134 SYM 0.9097
135 KTA 0.9097
136 HBU 0.9096
137 PBC 0.9096
138 93K 0.9096
139 NIO 0.9095
140 3HB 0.9094
141 B85 0.9094
142 SAL 0.9093
143 40E 0.9092
144 ITN 0.9090
145 DHB 0.9090
146 GJZ 0.9090
147 OXC 0.9090
148 ONL 0.9087
149 9J3 0.9087
150 FOC 0.9087
151 HPV 0.9085
152 1DV 0.9082
153 2HG 0.9080
154 SS2 0.9080
155 ASC 0.9079
156 SHA 0.9076
157 BAM 0.9075
158 4CS 0.9072
159 DAS 0.9070
160 SMN 0.9070
161 KVV 0.9070
162 OVV 0.9070
163 MET 0.9068
164 ZGL 0.9068
165 ACH 0.9068
166 4NG 0.9067
167 HIO 0.9063
168 XXG 0.9062
169 NCA 0.9062
170 FBT 0.9060
171 2IT 0.9060
172 ISD 0.9060
173 DAL DAL 0.9059
174 P4B 0.9059
175 INO 0.9059
176 QSB 0.9058
177 PZA 0.9057
178 SIF 0.9057
179 NMJ 0.9056
180 53C 0.9056
181 TRA 0.9055
182 DBX 0.9055
183 OMD 0.9055
184 4NC 0.9054
185 NIZ 0.9054
186 3MV 0.9053
187 IOM 0.9051
188 DHS 0.9050
189 G8M 0.9044
190 UNU 0.9039
191 CHB 0.9038
192 ORN 0.9038
193 PAH 0.9035
194 9TZ 0.9035
195 293 0.9034
196 NBZ 0.9034
197 1SA 0.9033
198 FA1 0.9033
199 2PN 0.9030
200 P9P 0.9030
201 4SX 0.9029
202 QSH 0.9028
203 VNL 0.9027
204 BNS 0.9026
205 FSG 0.9026
206 6M4 0.9024
207 TLA 0.9023
208 8OZ 0.9022
209 GGL 0.9020
210 9TW 0.9020
211 CXF 0.9018
212 OK7 0.9017
213 TPO 0.9016
214 X09 0.9016
215 PEL 0.9015
216 MUC 0.9012
217 5HY 0.9011
218 069 0.9009
219 SRT 0.9008
220 UGC 0.9007
221 IHB 0.9007
222 S2P 0.9006
223 AN0 0.9004
224 3Z8 0.9004
225 DYA 0.9002
226 45L 0.9002
227 271 0.9001
228 2LP 0.9001
229 CIT 0.9001
230 TZE 0.9000
231 GVM 0.8999
232 URS 0.8998
233 RB5 0.8996
234 XYL 0.8996
235 FPK 0.8994
236 GAG 0.8994
237 FAN 0.8993
238 YCP 0.8992
239 NPO 0.8992
240 SOL 0.8992
241 TEO 0.8991
242 S2G 0.8989
243 PEA 0.8989
244 3AL 0.8988
245 GTK 0.8988
246 7MU 0.8984
247 WCE 0.8984
248 97T 0.8983
249 2RH 0.8982
250 J9T 0.8982
251 AMS 0.8981
252 PHB 0.8980
253 ES6 0.8978
254 2D8 0.8978
255 Q02 0.8978
256 AW5 0.8976
257 1AL 0.8975
258 ICT 0.8975
259 SWA 0.8974
260 2HO 0.8974
261 3AB 0.8972
262 6JN 0.8969
263 EV0 0.8968
264 0P6 0.8966
265 AS3 0.8965
266 1LN 0.8964
267 NTN 0.8963
268 CYX 0.8963
269 HIS 0.8962
270 60P 0.8962
271 VGL 0.8961
272 MWP 0.8961
273 Q88 0.8960
274 DIG 0.8960
275 PIS 0.8960
276 DHY 0.8959
277 9RW 0.8958
278 LY0 0.8958
279 SD4 0.8957
280 TAR 0.8956
281 4XR 0.8956
282 QSC 0.8956
283 SHI 0.8955
284 NLE 0.8955
285 NCT 0.8955
286 VPR 0.8954
287 DQA 0.8952
288 MRZ 0.8952
289 8GL 0.8952
290 NXA 0.8951
291 8K2 0.8950
292 HY1 0.8950
293 HJP 0.8949
294 FA0 0.8948
295 JZ4 0.8947
296 PRY 0.8947
297 PAB 0.8946
298 J9Q 0.8945
299 GG6 0.8945
300 JZ7 0.8944
301 RNS 0.8944
302 GLY CYS 0.8943
303 FP1 0.8943
304 POP 0.8943
305 DBH 0.8942
306 98J 0.8941
307 SJ5 0.8940
308 PC 0.8939
309 4XV 0.8939
310 B2J 0.8938
311 I1E 0.8938
312 129 0.8938
313 4WK 0.8938
314 RUY 0.8937
315 261 0.8936
316 51F 0.8936
317 5MK 0.8936
318 XM0 0.8934
319 MDN 0.8933
320 DYT 0.8932
321 AC0 0.8932
322 AT3 0.8932
323 4JT 0.8932
324 1LQ 0.8932
325 EYK 0.8931
326 TRC 0.8930
327 SKM 0.8930
328 3SK 0.8929
329 ALA PRO 0.8927
330 3QM 0.8926
331 2AS 0.8926
332 3BU 0.8926
333 FUC 0.8926
334 BNF 0.8925
335 TIU 0.8924
336 3F0 0.8924
337 N4B 0.8923
338 3HA 0.8923
339 IP0 0.8922
340 GYE 0.8921
341 R9M 0.8921
342 AC6 0.8920
343 1P3 0.8918
344 5XB 0.8918
345 BSX 0.8915
346 LAO 0.8915
347 SKG 0.8914
348 AUD 0.8914
349 Q6T 0.8912
350 M58 0.8912
351 FK8 0.8911
352 B40 0.8910
353 92K 0.8910
354 AMQ 0.8910
355 HPA 0.8908
356 2TQ 0.8908
357 I2M 0.8908
358 CXP 0.8908
359 TAG 0.8908
360 PGH 0.8907
361 210 0.8907
362 M4T 0.8907
363 3U4 0.8905
364 ADE 0.8904
365 LSA 0.8903
366 KOJ 0.8901
367 GLO 0.8901
368 K6H 0.8900
369 ENL 0.8900
370 HBD 0.8900
371 PBZ 0.8899
372 FGZ 0.8893
373 5AC 0.8892
374 CEE 0.8890
375 5HN 0.8890
376 VNJ 0.8890
377 3BZ 0.8890
378 T9G 0.8889
379 Z82 0.8888
380 9DG 0.8886
381 9DA 0.8885
382 6CS 0.8885
383 GLY PRO 0.8884
384 4MA 0.8884
385 6MP 0.8883
386 CCB 0.8883
387 PBE 0.8883
388 263 0.8882
389 CTS 0.8882
390 1WD 0.8882
391 GBN 0.8881
392 1DJ 0.8881
393 PIY 0.8880
394 10L 0.8879
395 LYS 0.8879
396 NCD 0.8878
397 PCA 0.8878
398 3IT 0.8877
399 4HM 0.8876
400 SOR 0.8876
401 GVG 0.8876
402 HCI 0.8875
403 8EZ 0.8873
404 N7P 0.8872
405 5NU 0.8871
406 PLU 0.8870
407 XX2 0.8870
408 NNO 0.8870
409 7HP 0.8869
410 L99 0.8868
411 PSV 0.8868
412 J0Z 0.8868
413 2CO 0.8867
414 7A3 0.8867
415 XLS 0.8866
416 BHA 0.8865
417 FLC 0.8865
418 PPV 0.8864
419 RIB 0.8864
420 TZL 0.8864
421 ZBT 0.8864
422 GZL 0.8863
423 7WA 0.8863
424 9HX 0.8862
425 1Y6 0.8862
426 IJZ 0.8861
427 IT9 0.8860
428 KPL 0.8859
429 5CU 0.8857
430 P72 0.8857
431 OGA 0.8857
432 BP1 0.8856
433 HDH 0.8854
434 QDK 0.8853
435 APG 0.8853
436 NTM 0.8852
437 G4D 0.8852
438 MNN 0.8851
439 XX3 0.8850
440 4A3 0.8850
441 HSE 0.8850
442 DOB 0.8849
443 I38 0.8847
444 5ZZ 0.8847
445 7WG 0.8847
446 LNR 0.8846
447 MEQ 0.8846
448 GLC 0.8845
449 DCL 0.8845
450 4SV 0.8843
451 32O 0.8843
452 MXN 0.8843
453 IPZ 0.8842
454 FUB 0.8841
455 8GC 0.8840
456 FHB 0.8840
457 NVA 0.8840
458 XAN 0.8840
459 ES0 0.8838
460 5FX 0.8836
461 ILE 0.8836
462 3HP 0.8834
463 AFR 0.8834
464 4XS 0.8834
465 JZ3 0.8834
466 7B4 0.8833
467 LYL 0.8833
468 OTR 0.8833
469 3M0 0.8831
470 L5V 0.8831
471 1DQ 0.8830
472 URC 0.8829
473 52C 0.8828
474 XUL 0.8828
475 BDP 0.8827
476 AKH 0.8827
477 GUN 0.8826
478 LDP 0.8825
479 DAB 0.8824
480 2MN 0.8824
481 DGJ 0.8821
482 FE DB1 0.8820
483 2EH 0.8820
484 WOT 0.8820
485 4HC 0.8819
486 ES4 0.8818
487 3HM 0.8818
488 9MG 0.8817
489 K7M 0.8817
490 6LW 0.8816
491 HZP 0.8814
492 ASO 0.8814
493 42C 0.8814
494 SYV 0.8814
495 AIN 0.8813
496 5IQ 0.8813
497 HSO 0.8813
498 THE 0.8812
499 CWM 0.8812
500 ZXD 0.8812
501 4FA 0.8812
502 PM6 0.8811
503 MEV 0.8810
504 RAT 0.8810
505 BCU 0.8809
506 2CL 0.8809
507 QUS 0.8808
508 1SQ 0.8808
509 5SG 0.8808
510 N5J 0.8808
511 M6W 0.8807
512 AVI 0.8807
513 R8V 0.8806
514 YRL 0.8806
515 BGC 0.8806
516 OXQ 0.8805
517 JBH 0.8804
518 SWD 0.8804
519 2D0 0.8804
520 0OC 0.8804
521 1XA 0.8803
522 BZ3 0.8803
523 TYL 0.8802
524 X6X 0.8801
525 5QX 0.8800
526 8WT 0.8800
527 URF 0.8800
528 BRT 0.8800
529 LYN 0.8799
530 YIO 0.8799
531 F05 0.8799
532 ES1 0.8798
533 791 0.8798
534 3CU 0.8797
535 3S5 0.8797
536 GLA 0.8795
537 J9W 0.8795
538 GTR 0.8794
539 ADA 0.8794
540 HL4 0.8794
541 JPZ 0.8793
542 2FG 0.8793
543 2FY 0.8793
544 JFJ 0.8792
545 DII 0.8792
546 IT2 0.8791
547 GAF 0.8791
548 GBD 0.8791
549 4M0 0.8790
550 AMG 0.8789
551 4YS 0.8788
552 5RN 0.8787
553 1LM 0.8787
554 1NP 0.8787
555 VOH 0.8787
556 HY3 0.8786
557 HQJ 0.8786
558 KFH 0.8786
559 O72 0.8785
560 NOJ 0.8784
561 4P5 0.8783
562 SF9 0.8783
563 PIM 0.8782
564 X1S 0.8781
565 LCN 0.8779
566 4HP 0.8778
567 6AP 0.8777
568 HHH 0.8777
569 FOT 0.8776
570 NLG 0.8775
571 AHB 0.8775
572 GAL 0.8775
573 GCB 0.8775
574 MS9 0.8775
575 R2B 0.8774
576 ZZ3 0.8773
577 12M 0.8773
578 GLY ALA 0.8773
579 5Q0 0.8772
580 IFL 0.8771
581 GWM 0.8771
582 AEF 0.8771
583 KYD 0.8771
584 M1E 0.8770
585 HQY 0.8770
586 HGA 0.8770
587 FBJ 0.8769
588 MYQ 0.8769
589 XBT 0.8767
590 AH8 0.8767
591 AHR 0.8766
592 GIF 0.8766
593 MED 0.8766
594 NTC 0.8765
595 IHG 0.8764
596 N2Z 0.8764
597 I3A 0.8764
598 F12 0.8763
599 CFA 0.8763
600 BE7 0.8763
601 24W 0.8763
602 JLZ 0.8762
603 EKN 0.8761
604 2A7 0.8761
605 JBK 0.8760
606 DPF 0.8759
607 SNE 0.8759
608 3MB 0.8758
609 717 0.8757
610 8S0 0.8757
611 M1H 0.8756
612 RM1 0.8756
613 HHA 0.8755
614 CDT 0.8755
615 KT7 0.8753
616 HBA 0.8753
617 7A8 0.8752
618 CN0 0.8751
619 NDH 0.8751
620 KUF 0.8750
621 HQ9 0.8750
622 1AB 0.8750
623 JF6 0.8750
624 TB6 0.8749
625 M1A 0.8748
626 HDA 0.8748
627 HH5 0.8747
628 PHT 0.8747
629 KKN 0.8747
630 BTE 0.8745
631 ROR 0.8745
632 MPD 0.8745
633 QIC 0.8744
634 CFP 0.8743
635 4AA 0.8743
636 R1X 0.8742
637 PAF 0.8741
638 M3H 0.8740
639 GCU 0.8739
640 EUG 0.8738
641 S76 0.8738
642 67N 0.8738
643 BZX 0.8737
644 CS2 0.8737
645 6M9 0.8737
646 BDF 0.8736
647 SVN 0.8733
648 SIN 0.8733
649 3C4 0.8732
650 OVM 0.8732
651 JKZ 0.8731
652 TTL 0.8729
653 IGA 0.8728
654 IPB 0.8728
655 8TX 0.8727
656 SOE 0.8726
657 XQI 0.8726
658 VAH 0.8725
659 ABE 0.8725
660 KDG 0.8724
661 290 0.8724
662 FUM 0.8724
663 TMH 0.8722
664 0W8 0.8722
665 F0J 0.8722
666 UYA 0.8722
667 1SH 0.8721
668 NVU 0.8721
669 NLQ 0.8720
670 CWS 0.8720
671 A9P 0.8720
672 V55 0.8719
673 1XN 0.8719
674 PPK 0.8719
675 GUA 0.8717
676 7WV 0.8717
677 UY7 0.8717
678 M0Q 0.8716
679 149 0.8715
680 3PP 0.8715
681 4XH 0.8713
682 MNM 0.8713
683 ATH 0.8712
684 GLY GLY 0.8712
685 XIY 0.8712
686 42J 0.8711
687 BMA 0.8710
688 GIV 0.8710
689 AZA 0.8709
690 7UC 0.8709
691 AMC 0.8709
692 SMV 0.8709
693 HLZ 0.8706
694 ABV 0.8705
695 NOY 0.8705
696 DMV 0.8703
697 6FZ 0.8703
698 URP 0.8703
699 6XI 0.8702
700 4RW 0.8702
701 DBJ 0.8701
702 7W4 0.8701
703 ISN 0.8701
704 4ME 0.8700
705 HCS 0.8700
706 AC5 0.8700
707 3PO 0.8699
708 Z5P 0.8699
709 FUL 0.8699
710 9EW 0.8699
711 HH8 0.8698
712 DMJ 0.8698
713 NK 0.8698
714 G2F 0.8697
715 826 0.8696
716 O7U 0.8696
717 HX3 0.8695
718 3ID 0.8694
719 CP 0.8693
720 HYP 0.8693
721 RIP 0.8693
722 9X7 0.8692
723 ODV 0.8692
724 HBX 0.8690
725 9TY 0.8690
726 FCB 0.8690
727 0MK 0.8690
728 C2A 0.8690
729 HF2 0.8689
730 SYN 0.8689
731 IZC 0.8688
732 IFM 0.8687
733 X05 0.8687
734 ES7 0.8687
735 41K 0.8687
736 UNC 0.8686
737 PDC 0.8686
738 TYE 0.8685
739 REL 0.8685
740 LGC 0.8685
741 3S4 0.8684
742 F31 0.8684
743 P58 0.8684
744 EVA 0.8684
745 ODO 0.8683
746 SXS 0.8683
747 PPY 0.8683
748 AZG 0.8683
749 HX2 0.8683
750 DX4 0.8682
751 9RH 0.8682
752 DFB 0.8681
753 264 0.8681
754 2MI 0.8680
755 1P7 0.8680
756 25W 0.8680
757 911 0.8678
758 R20 0.8677
759 HSM 0.8676
760 2F6 0.8676
761 4TE 0.8675
762 G3F 0.8675
763 4VP 0.8675
764 7HQ 0.8674
765 X8Z 0.8674
766 X1E 0.8674
767 141 0.8674
768 TDR 0.8674
769 7A2 0.8674
770 OW4 0.8673
771 MBG 0.8672
772 7WR 0.8672
773 8CM 0.8671
774 FPI 0.8670
775 7VS 0.8669
776 LFR 0.8668
777 GCO 0.8668
778 A2F 0.8667
779 6TZ 0.8667
780 WOO 0.8666
781 E7Z 0.8663
782 RM4 0.8663
783 S0H 0.8663
784 PRO 0.8662
785 8SZ 0.8660
786 L3Q 0.8658
787 ALL 0.8658
788 KLW 0.8657
789 9X6 0.8656
790 K34 0.8656
791 MAN 0.8656
792 LT2 0.8656
793 270 0.8655
794 GIO 0.8655
795 HHT 0.8653
796 4PW 0.8653
797 DA4 0.8652
798 AX7 0.8652
799 SX1 0.8652
800 PHE 0.8652
801 COU 0.8651
802 DIN 0.8650
803 M0W 0.8649
804 3Z7 0.8649
805 JZ5 0.8647
806 174 0.8647
807 54D 0.8646
808 ABN 0.8646
809 1M2 0.8645
810 9YT 0.8644
811 2DR 0.8644
812 RJY 0.8643
813 FA6 0.8643
814 PSJ 0.8642
815 3YP 0.8642
816 WBU 0.8641
817 PA1 0.8641
818 DIU 0.8641
819 3PF 0.8640
820 4P0 0.8640
821 7VD 0.8640
822 GXL 0.8639
823 PCT 0.8638
824 3R9 0.8638
825 G6D 0.8637
826 FYU 0.8635
827 463 0.8635
828 RAM 0.8635
829 EOL 0.8634
830 OXZ 0.8634
831 RBJ 0.8634
832 ES5 0.8633
833 0F9 0.8633
834 MSE 0.8632
835 KBG 0.8631
836 14J 0.8629
837 12Q 0.8628
838 DFU 0.8628
839 GCS 0.8626
840 CTL 0.8625
841 2ZQ 0.8623
842 9KH 0.8622
843 7NI 0.8622
844 RBL 0.8622
845 HFA 0.8622
846 ADZ 0.8621
847 A7W 0.8620
848 03V 0.8620
849 2AQ 0.8620
850 HC4 0.8619
851 AOS 0.8619
852 3XX 0.8618
853 H42 0.8617
854 C2U 0.8617
855 EGR 0.8616
856 Q24 0.8615
857 2CK 0.8615
858 LRH 0.8615
859 APY 0.8615
860 4VY 0.8615
861 B62 0.8615
862 AX3 0.8613
863 MRW 0.8610
864 329 0.8610
865 IDM 0.8609
866 EHM 0.8608
867 N3W 0.8607
868 2PC 0.8607
869 DMD 0.8604
870 GV9 0.8604
871 7MH 0.8604
872 YH7 0.8603
873 OCH 0.8602
874 JTH 0.8602
875 ONR 0.8601
876 4FS 0.8600
877 B24 0.8599
878 DIE 0.8599
879 ABI 0.8598
880 6M1 0.8598
881 5WX 0.8598
882 2LY 0.8597
883 HMU 0.8596
884 LPK 0.8595
885 E35 0.8595
886 HA7 0.8595
887 4ZE 0.8595
888 MMA 0.8594
889 MCT 0.8592
890 O2A 0.8592
891 PYF 0.8592
892 JBE 0.8591
893 95Z 0.8590
894 5QY 0.8590
895 TM7 0.8587
896 6F0 0.8587
897 MHK 0.8584
898 64K 0.8582
899 MO8 0.8580
900 HXX 0.8579
901 TH7 0.8579
902 ZZT 0.8579
903 AZF 0.8578
904 15L 0.8577
905 0CU 0.8577
906 5OB 0.8577
907 NK2 0.8576
908 2BG 0.8575
909 V6F 0.8575
910 SYG 0.8574
911 OPE 0.8574
912 TSR 0.8571
913 4PN 0.8570
914 449 0.8569
915 TFB 0.8568
916 FBA 0.8567
917 23B 0.8565
918 9PY 0.8563
919 HDL 0.8563
920 M4S 0.8562
921 FAC 0.8561
922 7ME 0.8561
923 PH3 0.8560
924 4ZA 0.8558
925 XQ0 0.8558
926 B09 0.8551
927 4Z4 0.8550
928 C21 0.8550
929 1U1 0.8550
930 HMH 0.8542
931 M1Q 0.8541
932 5B1 0.8540
933 1WC 0.8540
934 IMR 0.8540
935 MZB 0.8539
936 PKU 0.8538
937 CNL 0.8534
938 SKA 0.8532
939 40F 0.8532
940 24B 0.8530
941 BEA 0.8530
942 FQI 0.8530
943 NK1 0.8529
944 T2C 0.8527
945 OVP 0.8525
946 3RK 0.8510
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3UWV; Ligand: 2PG; 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: 3uwv.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3UWV; Ligand: 2PG; 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: 3uwv.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
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