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Receptor
PDB id Resolution Class Description Source Keywords
1P31 1.85 Å EC: 6.3.2.8 CRYSTAL STRUCTURE OF UDP-N-ACETYLMURAMIC ACID:L-ALANINE LIGA FROM HAEMOPHILUS INFLUENZAE HAEMOPHILUS INFLUENZAE ALPHA/BETA PROTEIN LIGASE
Ref.: CRYSTAL STRUCTURES OF ACTIVE FULLY ASSEMBLED SUBSTR PRODUCT-BOUND COMPLEXES OF UDP-N-ACETYLMURAMIC ACID:L-ALANINE LIGASE (MURC) FROM HAEMOPHILUS INFLU J.BACTERIOL. V. 185 4152 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EPU A:598;
B:602;
Valid;
Valid;
none;
none;
submit data
677.4 C20 H29 N3 O19 P2 CC(=O...
MG A:611;
A:776;
B:601;
B:710;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1P31 1.85 Å EC: 6.3.2.8 CRYSTAL STRUCTURE OF UDP-N-ACETYLMURAMIC ACID:L-ALANINE LIGA FROM HAEMOPHILUS INFLUENZAE HAEMOPHILUS INFLUENZAE ALPHA/BETA PROTEIN LIGASE
Ref.: CRYSTAL STRUCTURES OF ACTIVE FULLY ASSEMBLED SUBSTR PRODUCT-BOUND COMPLEXES OF UDP-N-ACETYLMURAMIC ACID:L-ALANINE LIGASE (MURC) FROM HAEMOPHILUS INFLU J.BACTERIOL. V. 185 4152 2003
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1P31 - EPU C20 H29 N3 O19 P2 CC(=O)N[C@....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1P31 - EPU C20 H29 N3 O19 P2 CC(=O)N[C@....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1P31 - EPU C20 H29 N3 O19 P2 CC(=O)N[C@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: EPU; Similar ligands found: 68
No: Ligand ECFP6 Tc MDL keys Tc
1 EPU 1 1
2 EPZ 0.770642 0.957747
3 EEB 0.747748 0.944444
4 UD2 0.742857 0.971429
5 UD1 0.742857 0.971429
6 U21 0.704918 0.85
7 U20 0.704918 0.85
8 UMA 0.697479 0.957747
9 HP7 0.681818 0.957143
10 MJZ 0.675676 0.930556
11 UD7 0.666667 0.943662
12 UPG 0.644231 0.957143
13 UFM 0.644231 0.957143
14 GUD 0.644231 0.957143
15 GDU 0.644231 0.957143
16 UD4 0.640351 0.930556
17 F5G 0.640351 0.943662
18 F5P 0.640351 0.930556
19 UDZ 0.632479 0.87013
20 UAG 0.626866 0.906667
21 UPF 0.611111 0.905405
22 U2F 0.611111 0.905405
23 UGA 0.6 0.942857
24 UGB 0.6 0.942857
25 U22 0.6 0.829268
26 UFG 0.59633 0.905405
27 UDM 0.587719 0.930556
28 HWU 0.584746 0.917808
29 12V 0.584746 0.917808
30 UML 0.575342 0.85
31 USQ 0.571429 0.814815
32 UDX 0.567568 0.929577
33 UAD 0.567568 0.929577
34 UDP 0.554455 0.901408
35 UTP 0.553398 0.901408
36 G3N 0.552632 0.90411
37 UD0 0.542253 0.8375
38 660 0.540541 0.916667
39 URM 0.540541 0.916667
40 4RA 0.528169 0.848101
41 UPU 0.527778 0.928571
42 IUG 0.524194 0.804878
43 UNP 0.523364 0.876712
44 3UC 0.521368 0.905405
45 U 0.49505 0.887324
46 U5P 0.49505 0.887324
47 UDH 0.491228 0.833333
48 UPP 0.491228 0.902778
49 2KH 0.477064 0.876712
50 C5G 0.470588 0.905405
51 44P 0.466667 0.864865
52 2QR 0.458333 0.839506
53 Y6W 0.457627 0.88
54 UDP UDP 0.453704 0.873239
55 UAG API 0.453416 0.848101
56 UP5 0.44697 0.822785
57 2GW 0.440945 0.944444
58 4TC 0.42963 0.802469
59 1GW 0.428571 0.906667
60 CSQ 0.425197 0.844156
61 CSV 0.425197 0.844156
62 URI 0.424242 0.828571
63 PMP UD1 0.414474 0.82716
64 UMA FGA LYS DAL DAL 0.412791 0.817073
65 CJB 0.411765 0.814286
66 U U 0.406504 0.888889
67 U3P 0.401869 0.873239
68 UA3 0.401869 0.873239
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1P31; Ligand: EPU; Similar sites found with APoc: 839
This union binding pocket(no: 1) in the query (biounit: 1p31.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 4U8P UDP 1.05263
2 4U8P FDA 1.05263
3 2O4C NAD 1.05263
4 1UP7 NAD 1.19904
5 2DM6 NAP 1.2012
6 3L9W AMP 1.21065
7 3L9W GSH 1.21065
8 3VSE SAH 1.25628
9 5J5Z FAD 1.26316
10 4DSG FAD 1.26316
11 4DSG UDP 1.26316
12 4OOE NDP 1.26316
13 4OOE FOM 1.26316
14 3NKS FAD 1.26316
15 1Q9I FAD 1.26316
16 1Q9I TEO 1.26316
17 2F5Z FAD 1.26582
18 5ZYN FAD 1.27389
19 1PL6 572 1.40449
20 1PL6 NAD 1.40449
21 1ORR NAD 1.44092
22 5M67 3D1 1.47368
23 5M67 ADE 1.47368
24 5M67 NAD 1.47368
25 2WET FAD 1.47368
26 1V59 NAD 1.47368
27 1RSG FAD 1.47368
28 1YY5 FAD 1.47368
29 3CGD NAD 1.47368
30 3CGD COA 1.47368
31 1V59 FAD 1.47368
32 3CGD FAD 1.47368
33 3CGB FAD 1.47368
34 5D4V SAH 1.49254
35 4RPL FAD 1.50376
36 4RPL 3UC 1.50376
37 2Y6Q I7T 1.50754
38 2Y6Q FAD 1.50754
39 2GCG NDP 1.51515
40 1DLL LAT 1.5873
41 5X20 NAD 1.60256
42 5E9W SAH 1.60256
43 3KO8 NAD 1.60256
44 1P0F NAP 1.60858
45 4D3F NAP 1.6129
46 3LU1 NAD 1.64835
47 4D04 FAD 1.68421
48 4D04 NAP 1.68421
49 2RGO FAD 1.68421
50 4MOP 2H5 1.68421
51 3LAD FAD 1.68421
52 4PIV NDP 1.68421
53 1GZ4 ATP 1.68421
54 3LXD FAD 1.68675
55 3GMB FAD 1.68675
56 2IZ1 ATR 1.68776
57 5MLR GRQ 1.70316
58 5MLR NAP 1.70316
59 5YU3 NAD 1.74419
60 5YU3 PRO 1.74419
61 1LVL FAD 1.74672
62 1LVL NAD 1.74672
63 4PVD NDP 1.75439
64 1GY8 NAD 1.76322
65 3U4C NDP 1.77936
66 3AXB FAD 1.78571
67 3AXB PRO 1.78571
68 5L95 AMP 1.79211
69 6BQ6 TER 1.81269
70 1CER NAD 1.81269
71 3KLJ FAD 1.81818
72 3HB5 NAP 1.83486
73 4TQG NDP 1.85759
74 4D7E FAD 1.8648
75 1UWK URO 1.89474
76 1UWK NAD 1.89474
77 2ZXI FAD 1.89474
78 2QA1 FAD 1.89474
79 1DJN ADP 1.89474
80 2R4J FAD 1.89474
81 2R4J 13P 1.89474
82 1U8X NAD 1.90678
83 5GUD NDP 1.91083
84 5GUD 2IT 1.91083
85 6AIN FAD 1.91388
86 3ABI NAD 1.91781
87 1H2B NAJ 1.94986
88 1EBF NAD 1.95531
89 5LD5 NAD 1.95531
90 5TOW ADN 1.9656
91 5TOW NAI 1.9656
92 4OPC PGT 1.98676
93 4OPC FDA 1.98676
94 3ELW GP3 2
95 3ELW SAM 2
96 2NPX NAD 2.01342
97 1Z3C SA8 2.01342
98 2VVM FAD 2.0202
99 2VVL FAD 2.0202
100 5ZI2 NAD 2.02899
101 5ZI2 ADP 2.02899
102 1H9A NAP 2.06186
103 1T3D CYS 2.07612
104 5AOV NAP 2.08333
105 4B7X NAP 2.08333
106 1Q1R FAD 2.08817
107 2DBZ NAP 2.09581
108 1DSS NAD 2.1021
109 6EL3 NAP 2.10526
110 1X87 NAD 2.10526
111 1PS9 FAD 2.10526
112 1GQ2 NAP 2.10526
113 5YAP NAI 2.10526
114 5YAP 8S0 2.10526
115 2RGH FAD 2.10526
116 1MUU NAD 2.10526
117 6A0S NDP 2.10843
118 6A0S HSE 2.10843
119 6C4M NAP 2.1097
120 5Y77 FAD 2.11416
121 6GAS FAD 2.1148
122 2B9W FAD 2.12264
123 2CVQ NDP 2.14067
124 1D1T NAD 2.14477
125 4M52 M52 2.14592
126 4M52 FAD 2.14592
127 5MZI FAD 2.1692
128 5MZI FYK 2.1692
129 4MO2 FAD 2.17391
130 2V6G NAP 2.1978
131 5THQ NDP 2.20588
132 5NA1 FAD 2.20588
133 1Q0H FOM 2.21675
134 1Q0H NDP 2.21675
135 3WMX NAD 2.23464
136 5KKA 6V0 2.24359
137 2I3G NAP 2.27273
138 2NAD NAD 2.29008
139 5UR0 NAD 2.29226
140 4XUC SAM 2.29358
141 4XUC 43G 2.29358
142 1NFQ NAI 2.30769
143 1ELI PYC 2.31362
144 5DNK SAH 2.31579
145 1MO9 FAD 2.31579
146 1MO9 KPC 2.31579
147 3AYI HCI 2.31579
148 3AYI FAD 2.31579
149 5XWV NDP 2.31579
150 5XWV 8H6 2.31579
151 1OBB NAD 2.31579
152 4REP FAD 2.31579
153 1Y8Q ATP 2.31579
154 1FEC FAD 2.31579
155 1NAA 6FA 2.31579
156 4FWE FAD 2.31579
157 2A8X FAD 2.31579
158 1NAA ABL 2.31579
159 5TTJ FAD 2.31579
160 4MIG G3F 2.31579
161 3GDN HBX 2.31579
162 3GDN FAD 2.31579
163 5Z20 NAI 2.31884
164 3OJO NAD 2.32019
165 4JDR FAD 2.32068
166 3OID NDP 2.32558
167 4ZGS NAD 2.33161
168 1LLU NAD 2.33918
169 1F8G NAD 2.34375
170 3ICC NAP 2.35294
171 3NYC IAR 2.3622
172 3NYC FAD 2.3622
173 4FN4 NAD 2.3622
174 2XVF FAD 2.37069
175 1J5P NAD 2.37154
176 5Y8L NAD 2.37288
177 5Y8L HUI 2.37288
178 1CF2 NAP 2.37389
179 2YX1 SFG 2.38095
180 3SSO SAH 2.38663
181 4BVA T3 2.38806
182 4BVA NDP 2.38806
183 4EUE NAI 2.39234
184 4YT4 FE9 2.4
185 1U3U NAD 2.40642
186 1U3U BNF 2.40642
187 2GLX NDP 2.40964
188 1WP4 NDP 2.42215
189 2CVZ NDP 2.42215
190 2PZM NAD 2.42424
191 2PZM UDP 2.42424
192 5BUK FAD 2.44444
193 5BVA FAD 2.44499
194 6G28 AR6 2.45232
195 3FPZ AHZ 2.45399
196 5K4W THR 2.49221
197 5K4W NAI 2.49221
198 4USR FAD 2.49307
199 5J60 FAD 2.5
200 5GWT SIN 2.51799
201 5GWT NAD 2.51799
202 3OZ2 FAD 2.51889
203 3E1T FAD 2.52632
204 1RYI GOA 2.52632
205 1RYI FAD 2.52632
206 1XHC FAD 2.52632
207 1GTE FAD 2.52632
208 4K5S FAD 2.52632
209 4K5S PM0 2.52632
210 4Z24 FAD 2.52632
211 6FP4 E1T 2.52632
212 2RH4 EMO 2.52708
213 1BXG NAD 2.52809
214 1BW9 NAD 2.52809
215 1C1X NAD 2.53521
216 4CNK FAD 2.55754
217 3GF4 UPG 2.5641
218 3GF4 FAD 2.5641
219 3QWI NAP 2.59259
220 3QWI CUE 2.59259
221 5G3U FDA 2.60047
222 5G3U ITW 2.60047
223 5XVH NAP 2.61438
224 1C3X 8IG 2.63158
225 5JE8 NAD 2.64901
226 1R6D DAU 2.67062
227 1R6D NAD 2.67062
228 1ZEM NAD 2.67176
229 4ZCC NAI 2.67857
230 4ZCC FAD 2.67857
231 5JAQ NAI 2.70936
232 1SC6 NAD 2.72277
233 4NBW NAD 2.72374
234 1I8T FAD 2.7248
235 1B8U OAA 2.73556
236 1B8U NAD 2.73556
237 4RSL FAD 2.73684
238 4EMI NAD 2.73684
239 3RC1 NAP 2.73684
240 3RC1 TLO 2.73684
241 3ICS ADP 2.73684
242 1GPE FAD 2.73684
243 1I2B USQ 2.73684
244 1I2B NAD 2.73684
245 1I2B UPG 2.73684
246 6F97 FAD 2.73684
247 3ICT ADP 2.73684
248 1D4D FAD 2.73684
249 5OC1 FAD 2.73684
250 5WKC FAD 2.73684
251 3S5W FAD 2.73684
252 5YB7 FAD 2.73684
253 1PN0 FAD 2.73684
254 5WP5 SAH 2.73684
255 1PN0 IPH 2.73684
256 5YB7 ORN 2.73684
257 5EB4 FAD 2.73684
258 3ICT FAD 2.73684
259 1YS4 NAP 2.73684
260 2NVK FAD 2.73684
261 3ICS FAD 2.73684
262 3T31 FAD 2.746
263 3T31 DCQ 2.746
264 1EJ0 SAM 2.77778
265 4PIO SAH 2.78638
266 4PIO AVI 2.78638
267 1U1I NAD 2.80612
268 1A5Z NAD 2.82132
269 5T2U NAP 2.82258
270 3NUG NAD 2.83401
271 1YKF NAP 2.84091
272 5N0J FAD 2.849
273 1L7E NAI 2.86458
274 3O9Z AKG 2.88462
275 3O9Z NAD 2.88462
276 2YY7 NAD 2.88462
277 2B4R NAD 2.89855
278 2B4R AES 2.89855
279 3VPH OXM 2.90323
280 3VPH NAD 2.90323
281 2GN4 UD1 2.90698
282 2GN4 NDP 2.90698
283 2VHW NAI 2.91777
284 2YVF FAD 2.94118
285 2YVF NAD 2.94118
286 1TKU 5RP 2.94118
287 5WGR FAD 2.94737
288 2JB2 FAD 2.94737
289 2JB2 PHE 2.94737
290 3WQQ IB3 2.94737
291 3WQQ NDP 2.94737
292 4C3Y FAD 2.94737
293 2DKH 3HB 2.94737
294 2DKH FAD 2.94737
295 4EIP FAD 2.94737
296 2HQM FAD 2.94737
297 3IHG FAD 2.94737
298 1REO FAD 2.94737
299 4AT0 FAD 2.94737
300 4C3Y ANB 2.94737
301 2GMH FAD 2.94737
302 1QO8 FAD 2.94737
303 2AOT SAH 2.94737
304 1RJW ETF 2.94985
305 1UDB UFG 2.95858
306 1UDB NAD 2.95858
307 5A3B APR 2.9703
308 3L4S NAD 2.97619
309 3L4S 3PG 2.97619
310 1JG3 ADN 2.97872
311 3KB6 NAD 2.99401
312 6FDF SAH 2.99401
313 1J49 NAD 3.003
314 2PV7 NAD 3.02013
315 3FPF TNA 3.02013
316 3FPF MTA 3.02013
317 4G5H UD7 3.0303
318 4G5H NAP 3.0303
319 2IVN ANP 3.0303
320 5GT9 NAP 3.04183
321 1SAY PYR 3.04709
322 3AB1 FAD 3.05556
323 1K3T BRZ 3.06407
324 4CQM NAP 3.06513
325 1E3W NAD 3.06513
326 2AE2 NAP 3.07692
327 2AE2 PTO 3.07692
328 1E6W NAD 3.07692
329 1X1T NAD 3.07692
330 4AP3 FAD 3.09654
331 4AP3 NAP 3.09654
332 5T67 JHZ 3.125
333 5T67 SAH 3.125
334 4J36 FAD 3.13253
335 4J36 1HR 3.13253
336 2D2I NAP 3.15789
337 2AQJ FAD 3.15789
338 2AQJ TRP 3.15789
339 2EV9 SKM 3.15789
340 2EV9 NAP 3.15789
341 2DC1 NAD 3.15789
342 1ZQ9 SAM 3.15789
343 1H82 FAD 3.15789
344 2IV2 2MD 3.15789
345 1H82 GZZ 3.15789
346 1TMO 2MD 3.15789
347 4HA6 FAD 3.15789
348 2IID FAD 3.15789
349 2IID PHE 3.15789
350 5TWB FAD 3.19767
351 4ZRN NAD 3.20513
352 4ZRN UPG 3.20513
353 2JHF NAD 3.20856
354 2Q0L FAD 3.21543
355 5A1T OXM 3.22581
356 5A1T NAI 3.22581
357 1GUZ NAD 3.22581
358 2RGJ FAD 3.23383
359 3GEG NAD 3.23887
360 3UW4 MAA CHG PRO 0DQ 3.26087
361 4L8V NAP 3.2641
362 4M73 M72 3.2641
363 4M73 SAH 3.2641
364 1HDR NAD 3.27869
365 4KP7 NAP 3.27869
366 4KP7 1UQ 3.27869
367 4NTC FAD 3.28358
368 1O6Z NAD 3.30033
369 4KOA NDP 3.3033
370 5T9E NAP 3.32103
371 1KEW NAD 3.3241
372 1KEW TYD 3.3241
373 1JNR FAD 3.33333
374 2G5C NAD 3.36842
375 2C5A GDC 3.36842
376 2C5A NAD 3.36842
377 5TS5 FAD 3.36842
378 1VL8 NAP 3.37079
379 3LCC SAH 3.40426
380 6A3J SOE 3.41463
381 6A3J NAI 3.41463
382 5UAV NDP 3.41615
383 5UAV TFB 3.41615
384 1YB5 NAP 3.4188
385 4KWI NAP 3.42205
386 4KWI 1TJ 3.42205
387 4OSP NAP 3.42205
388 5FEU NAP 3.43643
389 3TWO NDP 3.44828
390 1E3I CXF 3.45745
391 4J4H 1J1 3.4749
392 4J4H NAI 3.4749
393 4JK3 NAD 3.4749
394 3A28 NAD 3.48837
395 4JNA FAD 3.52941
396 3B1J NAD 3.53982
397 3B20 NAD 3.53982
398 1RM4 NDP 3.56083
399 5EJ2 NAD 3.57143
400 1LTH NAD 3.57895
401 3NDJ JHZ 3.57895
402 3NDJ SAH 3.57895
403 1PZG A3D 3.57895
404 3FXU TSU 3.57895
405 5UAO FAD 3.57895
406 5U8U FAD 3.57895
407 2IXB NAD 3.6036
408 2IXB A2G 3.6036
409 6BII NAP 3.6036
410 3LZW FAD 3.61446
411 3LZW NAP 3.61446
412 1HDG NAD 3.61446
413 5NUF NAD 3.61446
414 2IYF UDP 3.61446
415 5NUE NAD 3.61446
416 4PLT OXM 3.62538
417 4PLT NAI 3.62538
418 1JA9 NDP 3.64964
419 5MIT FAD 3.66972
420 5MIT NAP 3.66972
421 5Z2L NDP 3.67347
422 5HXI FAD 3.69393
423 5HXI 5HN 3.69393
424 5KMS FAD 3.7037
425 4YAC NAI 3.7037
426 1X7D ORN 3.71429
427 1X7D NAD 3.71429
428 1CDO NAD 3.74332
429 5HWK BEZ 3.75
430 3OA2 NAD 3.77358
431 5XNC MTA 3.77358
432 1EZ4 NAD 3.77358
433 4YAG NAI 3.78947
434 1I1E DM2 3.78947
435 4B63 ORN 3.79242
436 4B63 FAD 3.79242
437 4B63 NAP 3.79242
438 3V1Y NAD 3.85757
439 6CI9 NAP 3.861
440 4GKV NAD 3.86905
441 1GV0 NAD 3.87097
442 5FFF 5XC 3.89105
443 5FFF NAP 3.89105
444 4Z0H NAD 3.89222
445 1WRA PC 3.8961
446 1J0X NAD 3.91566
447 1PJS NAD 3.93873
448 1NM5 NAD 3.94089
449 5FJN BE2 3.94737
450 5FJN FAD 3.94737
451 5JCM NAD 3.99113
452 5JCM FAD 3.99113
453 5JCM ISD 3.99113
454 5Y1G AKB 4
455 4OM8 NAD 4
456 5Y1G NAD 4
457 5BRT CH9 4
458 1YBH FAD 4
459 5BRT FAD 4
460 1KYQ NAD 4.0146
461 2FZW NAD 4.02145
462 1T26 NAI 4.03727
463 1T26 GBD 4.03727
464 2YYY NAP 4.08163
465 4EA7 JB2 4.09091
466 4EA7 COA 4.09091
467 1YQD NAP 4.09836
468 2GZ3 NAP 4.09836
469 3A4V NAD 4.10095
470 3A4V PYR 4.10095
471 5DM1 5D7 4.11985
472 5DM1 SAH 4.11985
473 3NJ4 AFX 4.13793
474 3NJ4 NAD 4.13793
475 1H6C NDP 4.15704
476 1H6C SIN 4.15704
477 1RM0 D6P 4.21053
478 1RM0 NAI 4.21053
479 1V8B NAD 4.21053
480 3UCL FAD 4.21053
481 3UCL NAP 4.21053
482 3UCL CYH 4.21053
483 5HSA FAS 4.21053
484 1PVS 7HP 4.21053
485 4RF2 NAP 4.21053
486 2IVD FAD 4.21053
487 4YNU FAD 4.21053
488 1HKU NAD 4.21053
489 4YNU LGC 4.21053
490 1ZK4 NAP 4.21053
491 1V6A TRE 4.21687
492 4IDC NDP 4.21687
493 4IDC 1XX 4.21687
494 1BXK NAD 4.22535
495 6C4N NAP 4.23163
496 1GAD NAD 4.24242
497 4XT8 NAP 4.26357
498 4XT8 TMQ 4.26357
499 1KOL NAD 4.27136
500 4M1U A2G MBG 4.28571
501 2BGM NAJ 4.31655
502 2RAB FAD 4.31965
503 2RAB NAD 4.31965
504 2WSB NAD 4.33071
505 3H9E NAD 4.33526
506 2PT9 2MH 4.36137
507 4J56 FAD 4.38596
508 4NTD FAD 4.41176
509 1UXG NAD 4.42105
510 1UXG FUM 4.42105
511 1KEV NDP 4.42105
512 1G0N PHH 4.42105
513 1G0N NDP 4.42105
514 3O03 NAP 4.42105
515 4BJZ P3A 4.42105
516 4BJZ FAD 4.42105
517 4MP8 NAD 4.42478
518 4MP8 MLI 4.42478
519 5A04 BGC 4.42478
520 5A04 NDP 4.42478
521 3CIF G3H 4.45682
522 3CIF NAD 4.45682
523 5Z21 NAI 4.46927
524 1FWV SGA MAG FUC 4.47761
525 2BD0 NAP 4.5082
526 4TM3 FAD 4.51467
527 1SOW NAD 4.57317
528 2OOR NAD 4.5977
529 1RLZ NAD 4.60705
530 3BGD PM6 4.61538
531 3NOJ PYR 4.62185
532 3ZV6 4HB 4.62633
533 3ZV6 NAD 4.62633
534 5GSN MMZ 4.63158
535 5GSN NAP 4.63158
536 5GSN FAD 4.63158
537 4RVG TYD 4.63158
538 4URF NAD 4.63158
539 2GSD NAD 4.63158
540 5MBX FAD 4.63158
541 5MBX SP5 4.63158
542 4RVG SAM 4.63158
543 1E5Q NDP 4.63158
544 5BJX NAD 4.64481
545 5BJX UDP 4.64481
546 2VT3 ATP 4.65116
547 4JJF N2I 4.65116
548 4JJF FE9 4.65116
549 1RYD NDP 4.65116
550 5N6C NAD 4.66667
551 1BDB NAD 4.69314
552 2Q2V NAD 4.70588
553 2Q46 NAP 4.74308
554 3V1U NAD 4.7619
555 2Q1S NAI 4.77454
556 4X9M FAD 4.78469
557 3HDY FAD 4.78589
558 3HDY GDU 4.78589
559 3HDY FDA 4.78589
560 3BAZ NAP 4.8048
561 5ZZ6 NAD 4.80769
562 5ZZ6 ADP 4.80769
563 4ITU 1HS 4.83271
564 4ITU NAI 4.83271
565 3UOY NAP 4.84211
566 3UOY FAD 4.84211
567 4ZUL UN1 4.84211
568 1SB8 UD2 4.84211
569 1SB8 NAD 4.84211
570 4IV9 FAD 4.8474
571 3EGI ADP 4.85437
572 3BMN NAP 4.86111
573 3JQF NAP 4.86111
574 3BMQ NAP 4.86111
575 5K6A NAP 4.86111
576 4CM9 NAP 4.86111
577 3JQB NAP 4.86111
578 3JQ8 NAP 4.86111
579 4CM4 NAP 4.86111
580 4CM8 NAP 4.86111
581 4CMI NAP 4.86111
582 6GAR FAD 4.87106
583 1R37 NAD 4.89914
584 2DTX BMA 4.92424
585 1NV8 MEQ 4.92958
586 1NV8 SAM 4.92958
587 2I7C AAT 4.947
588 4J1Q NDP 4.9569
589 4USQ FAD 4.98615
590 1E1M NAP 5
591 1E1M FAD 5
592 1LSS NAD 5
593 5OJL TXP 5.03356
594 3AD8 NAD 5.05051
595 4HXY NDP 5.05263
596 2XVE FAD 5.05263
597 1YKJ PHB 5.07614
598 1YKJ FAD 5.07614
599 3GGO ENO 5.09554
600 3GGO NAI 5.09554
601 5O42 NAD 5.10949
602 5O42 BGC 5.10949
603 5O42 9JW 5.10949
604 1L5Y BEF 5.16129
605 1EK6 NAI 5.17241
606 1OC2 NAD 5.17241
607 1OC2 TDX 5.17241
608 1EK6 UPG 5.17241
609 6BWL NAD 5.18293
610 2DFV NAD 5.18732
611 3HAD NAD 5.19481
612 1NVM NAD 5.21739
613 3T7S SAM 5.22388
614 2VZ0 D64 5.22388
615 2VZ0 NAP 5.22388
616 6DNT NAD 5.23256
617 5VKT NAP 5.24862
618 1GR0 NAD 5.26316
619 5DN9 NAD 5.26316
620 2E5V FAD 5.29661
621 2AG8 NAP 5.32319
622 1U7T TDT 5.36398
623 3CMC NAD 5.38922
624 4RVU NDP 5.42169
625 5U5G NAP 5.42373
626 2FKA BEF 5.42636
627 4O0L NDP 5.45455
628 5UFN SAH 5.46218
629 3WGT QSC 5.4755
630 3WGT FAD 5.4755
631 3IT7 TLA 5.49451
632 2YG3 FAD 5.51876
633 1XCL SAH 5.53191
634 5EIN NAP 5.55556
635 3H4V NAP 5.55556
636 3H4V DVP 5.55556
637 2CFC NAD 5.6
638 2A92 NAI 5.60748
639 2EWM NAD 5.62249
640 1RP0 AHZ 5.6338
641 1MV8 NAD 5.68421
642 6CZ7 MGD 5.68421
643 4EDF UPG 5.68421
644 1L7N ALF 5.6872
645 4PLG NAI 5.68862
646 4PLG OXM 5.68862
647 1N1G BCP 5.7377
648 3ZNN FAD 5.76369
649 3ZNN 4WL 5.76369
650 1GET FAD 5.77778
651 1GET NAP 5.77778
652 6H3O FAD 5.83717
653 2XYQ SAH 5.86207
654 1ZH8 NAP 5.88235
655 5T9F TYR 5.89474
656 5T9F NAP 5.89474
657 3RJ5 NAD 5.90551
658 3ORF NAD 5.9761
659 6FHO FAD 6.01504
660 3QFA FAD 6.03448
661 5GM1 SAH 6.06061
662 1JQ3 AAT 6.08108
663 4NBT NAD 6.10526
664 3WBF NAP 6.10526
665 3A06 FOM 6.11702
666 3A06 NDP 6.11702
667 5NMX FAD 6.11765
668 5NMX NAP 6.11765
669 6F3N ADN 6.14407
670 6F3N NAD 6.14407
671 3OND NAD 6.14754
672 3OND ADN 6.14754
673 5AYV KPL 6.14887
674 1F8F NAD 6.19946
675 3AFN NAP 6.20155
676 5O4J PJL 6.20438
677 5O4J 9KH 6.20438
678 5O4J SAH 6.20438
679 5O9F NAD 6.25
680 5O9F 9ON 6.25
681 1P77 ATR 6.25
682 2NXE SAM 6.29921
683 6F3M NAD 6.30435
684 2BRY FAD 6.31579
685 4RQU NAD 6.31579
686 4TXI FAD 6.31579
687 1EU1 MGD 6.31579
688 4ZA2 NAD 6.32411
689 4DMG SAM 6.36132
690 1IY8 NAD 6.36704
691 5CAE SIN 6.38978
692 5CAE COA 6.38978
693 1WDK NAD 6.41026
694 3QJ4 FAD 6.43275
695 5U19 827 6.45161
696 5U19 SAH 6.45161
697 2ZJ1 NAD 6.52632
698 2ZJ1 ARJ 6.52632
699 3RFV NAI 6.52632
700 3RFV 15L 6.52632
701 1BZL GCG 6.52632
702 1BZL FAD 6.52632
703 1P1C SAH 6.53266
704 1Q7B NAP 6.55738
705 1NXJ TLA 6.55738
706 4YUW S4M 6.57895
707 1LDN NAD 6.64557
708 3VC1 GST 6.73077
709 3VC1 SAH 6.73077
710 3WV8 ATP 6.73684
711 2GDZ NAD 6.74157
712 1L3I SAH 6.77083
713 1VQW FAD 6.78337
714 3C6K MTA 6.82415
715 3C6K SPD 6.82415
716 2VYN NAD 6.88623
717 6CEP NAD 6.88623
718 6CEP OXM 6.88623
719 3B1F NAD 6.89655
720 6EQS BV8 6.90909
721 2GVC FAD 6.93512
722 2GV8 FAD 6.93512
723 2GV8 NDP 6.93512
724 4XQC NAD 6.94737
725 4XQC 13D 6.94737
726 3NTA FAD 6.94737
727 5K0A FAD 6.9697
728 6F7L FAD 7.01357
729 2P3V SRT 7.03125
730 1GEG NAD 7.03125
731 5JCA FAD 7.04225
732 5JCA NDP 7.04225
733 1XHL NDP 7.07071
734 3DMH GMP 7.08661
735 1OMO NAD 7.14286
736 3GFB NAD 7.14286
737 1HSL HIS 7.14286
738 2Z3Y F2N 7.15789
739 4Y9D NAI 7.15789
740 5X68 FAD 7.16113
741 2Q1W NAD 7.20721
742 5OCM NAP 7.2165
743 4YRY NAD 7.24638
744 4YRY FAD 7.24638
745 4GUS FAD 7.25806
746 4HSU FAD 7.25806
747 4GUT FAD 7.25806
748 4E5N NAD 7.27273
749 2YVJ NAI 7.33945
750 2YVJ FAD 7.33945
751 3Q3C NAD 7.35786
752 4A6F SEP 7.5
753 2B4Q NAP 7.6087
754 2Q7V FAD 7.69231
755 3CM2 X23 7.69231
756 2VPY MGD 7.69231
757 5I39 FAD 7.78947
758 4ZVV NAD 7.83133
759 4ZVV GN0 7.83133
760 6ER9 FAD 8
761 6ER9 NAP 8
762 1KQF MGD 8
763 5VN0 NAI 8
764 5VN0 FAD 8
765 2AG5 NAD 8.13008
766 1C3V NDP 8.16327
767 4IF4 BEF 8.17308
768 5DF1 58X 8.21053
769 5DF1 NAP 8.21053
770 3NTD FAD 8.21053
771 4YSX FAD 8.33333
772 4MDH NAD 8.38323
773 5MDH NAD 8.40841
774 1VKO NAD 8.42105
775 6F9Q NAD 8.42105
776 1AE1 NAP 8.42491
777 3JUC PCA 8.49673
778 3QV1 NAD 8.53659
779 3HVJ 705 8.59729
780 1Z45 NAD 8.63158
781 2HJR APR 8.63158
782 1DLJ UGA 8.70647
783 1DLJ NAI 8.70647
784 4CJX NAP 8.77743
785 4R6W PC 8.91473
786 4R6W SAH 8.91473
787 2DT5 NAD 9.00474
788 3CTY FAD 9.05263
789 1HYH NAD 9.05263
790 5G4L NDP 9.09091
791 4M7V RAR 9.14286
792 4II2 ATP 9.20245
793 5ODQ FAD 9.23913
794 2HK9 NAP 9.26316
795 2HK9 ATR 9.26316
796 9LDT NAD 9.26316
797 1LDM NAD 9.26316
798 9LDB NAD 9.26316
799 1H5Q NAP 9.43396
800 3WLE NAD 9.67742
801 2F1K NAP 9.67742
802 2CDU FAD 9.68421
803 2CDU ADP 9.68421
804 4W6Z 8ID 9.79827
805 1UAY ADN 9.91736
806 3SJ7 NDP 9.92064
807 5ZI9 FLC 10
808 5WUW NAP 10.1045
809 1E6E FAD 10.1562
810 1O94 ADP 10.2273
811 1O97 AMP 10.2273
812 1O97 FAD 10.2273
813 4XYB NDP 10.2302
814 1DMR PGD 10.3158
815 4GLL NAD 10.3858
816 4XB2 HSE 10.4478
817 4XB2 NDP 10.4478
818 5Z75 NAD 10.5263
819 5DLY 5D7 10.5263
820 5DLY SAH 10.5263
821 5NM7 GLY 10.5263
822 5JY6 NAD 10.6742
823 1J3I NDP 10.9474
824 3D3W NAP 11.0656
825 3ZIA ADP 11.1111
826 4NBU NAI 11.2
827 1GZ6 NAI 11.2853
828 1X14 NAD 11.4713
829 3GRU AMP 11.5254
830 3G89 SAM 11.6466
831 2GAG NAD 11.9048
832 1EDO NAP 12.2951
833 1I1N SAH 12.8319
834 1ZBQ NAD 12.8421
835 3X0V FAD 13.4737
836 1O0S NAI 14.3158
837 2VTD LKM 28.3146
838 3RNM FAD 29.3103
839 5E8J SAH 31.8182
Pocket No.: 2; Query (leader) PDB : 1P31; Ligand: EPU; Similar sites found with APoc: 61
This union binding pocket(no: 2) in the query (biounit: 1p31.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 5JWC FAD 1.05263
2 2E7Z MGD 1.26316
3 3QVP FAD 1.47368
4 4MO2 FDA 2.17391
5 3KJS NAP 2.31579
6 4PNE SAH 2.31788
7 2VDV SAM 2.43902
8 5TUF TDC 2.44499
9 5TUF FAD 2.44499
10 1C0I BE2 2.47934
11 1C0I FAD 2.47934
12 5CMK LY5 2.7027
13 2AHR NAP 2.7027
14 1T9D 1MM 2.73684
15 1T9D FAD 2.73684
16 3ICR FAD 2.73684
17 1T9D P22 2.73684
18 6DEN TP9 2.94737
19 6DEN FAD 2.94737
20 6DEN G8A 2.94737
21 2WPF FAD 2.94737
22 1YQZ FAD 2.96804
23 4KIB SAH 3.08123
24 4KGD FAD 3.15789
25 4KGD TDP 3.15789
26 2B6N ALA PRO THR 3.59712
27 2CJW GDP 3.64583
28 5KMS NAD 3.7037
29 2O07 SPD 3.94737
30 2O07 MTA 3.94737
31 5EOW FAD 4
32 2HT6 GDP 4.02299
33 5BW4 SAM 4.11985
34 1JXN MFU 4.13223
35 5EZ7 FAD 4.33673
36 2FR1 NDP 4.42105
37 3ML1 MGD 4.44444
38 4H0I MMA 4.78088
39 3JQ9 NAP 4.86111
40 3BMO NAP 4.86111
41 3FZG SAM 5
42 2B5W NAP 5.04202
43 1GJW GLC 5.05263
44 3DDN HPV 5.05263
45 5KOX FAD 5.05263
46 5KOX RFP 5.05263
47 2RC8 DSN 5.10204
48 2C7G ODP 5.26316
49 2C7G FAD 5.26316
50 1COY FAD 5.26316
51 5TPC GAL SIA NGA GAL SIA 5.41176
52 3DAG FEG 5.47368
53 5M6N 7H9 5.9322
54 4YUW 4JU 6.57895
55 3FGZ BEF 6.73684
56 4NON GDP 7.30769
57 5OQW A4E 7.87402
58 6AA8 NAD 11.5894
59 4K7O EKZ 13.6905
60 4L2I FAD 19.0114
61 2V7Q ADP 19.697
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