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Receptor
PDB id Resolution Class Description Source Keywords
1ELI 2 Å EC: 1.5.3.1 COMPLEX OF MONOMERIC SARCOSINE OXIDASE WITH THE INHIBITOR PY CARBOXYLATE BACILLUS SP. FLAVOPROTEIN OXIDASE OXIDOREDUCTASE
Ref.: MONOMERIC SARCOSINE OXIDASE: 1. FLAVIN REACTIVITY A SITE BINDING DETERMINANTS. BIOCHEMISTRY V. 39 8813 2000
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:804;
B:814;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
FAD A:400;
B:400;
Invalid;
Invalid;
none;
none;
submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
PO4 A:803;
B:812;
B:813;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
94.971 O4 P [O-]P...
PYC A:801;
B:811;
B:815;
Valid;
Valid;
Valid;
none;
none;
none;
Kd = 1.37 mM
110.091 C5 H4 N O2 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1ELI 2 Å EC: 1.5.3.1 COMPLEX OF MONOMERIC SARCOSINE OXIDASE WITH THE INHIBITOR PY CARBOXYLATE BACILLUS SP. FLAVOPROTEIN OXIDASE OXIDOREDUCTASE
Ref.: MONOMERIC SARCOSINE OXIDASE: 1. FLAVIN REACTIVITY A SITE BINDING DETERMINANTS. BIOCHEMISTRY V. 39 8813 2000
Members (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L9D - PYC C5 H4 N O2 c1cc([nH]c....
2 1EL5 Kd = 17.4 mM DMG C4 H9 N O2 CN(C)CC(=O....
3 2GF3 - FOA C5 H4 O3 c1cc(oc1)C....
4 1EL7 Kd = 1.46 mM MTD C3 H5 O2 Te C[Te]CC(=O....
5 1EL9 Kd = 2.6 mM MTG C3 H5 O2 S CSCC(=O)[O....
6 3M12 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 1EL8 Kd = 2.13 mM MSF C3 H5 O2 Se C[Se]CC(=O....
8 3QSS Kd = 4.9 mM MTG C3 H5 O2 S CSCC(=O)[O....
9 3QSE Kd > 10 mM SAR C3 H7 N O2 CNCC(=O)O
10 1ELI Kd = 1.37 mM PYC C5 H4 N O2 c1cc([nH]c....
70% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L9D - PYC C5 H4 N O2 c1cc([nH]c....
2 1EL5 Kd = 17.4 mM DMG C4 H9 N O2 CN(C)CC(=O....
3 2GF3 - FOA C5 H4 O3 c1cc(oc1)C....
4 1EL7 Kd = 1.46 mM MTD C3 H5 O2 Te C[Te]CC(=O....
5 1EL9 Kd = 2.6 mM MTG C3 H5 O2 S CSCC(=O)[O....
6 3M12 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 1EL8 Kd = 2.13 mM MSF C3 H5 O2 Se C[Se]CC(=O....
8 3QSS Kd = 4.9 mM MTG C3 H5 O2 S CSCC(=O)[O....
9 3QSE Kd > 10 mM SAR C3 H7 N O2 CNCC(=O)O
10 1ELI Kd = 1.37 mM PYC C5 H4 N O2 c1cc([nH]c....
50% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L9D - PYC C5 H4 N O2 c1cc([nH]c....
2 1EL5 Kd = 17.4 mM DMG C4 H9 N O2 CN(C)CC(=O....
3 2GF3 - FOA C5 H4 O3 c1cc(oc1)C....
4 1EL7 Kd = 1.46 mM MTD C3 H5 O2 Te C[Te]CC(=O....
5 1EL9 Kd = 2.6 mM MTG C3 H5 O2 S CSCC(=O)[O....
6 3M12 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 1EL8 Kd = 2.13 mM MSF C3 H5 O2 Se C[Se]CC(=O....
8 3QSS Kd = 4.9 mM MTG C3 H5 O2 S CSCC(=O)[O....
9 3QSE Kd > 10 mM SAR C3 H7 N O2 CNCC(=O)O
10 1ELI Kd = 1.37 mM PYC C5 H4 N O2 c1cc([nH]c....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PYC; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 PYC 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1ELI; Ligand: PYC; Similar sites found with APoc: 776
This union binding pocket(no: 1) in the query (biounit: 1eli.bio1) has 43 residues
No: Leader PDB Ligand Sequence Similarity
1 5FWA J7C 1.28535
2 3DMH SAM 1.31234
3 3DMH GMP 1.31234
4 4DCM SAM 1.33333
5 1X7D NAD 1.42857
6 1PJS NAD 1.54242
7 3GMB FAD 1.54242
8 1OBB NAD 1.54242
9 1UAY ADN 1.65289
10 3LST SAH 1.72414
11 3TKA SAM 1.72911
12 2AIQ BEN 1.7316
13 1KPH SAH 1.74216
14 1KPG SAH 1.74216
15 1WG8 SAM 1.75439
16 2F1K NAP 1.79211
17 5X62 SAH 1.79949
18 5KOK SAH 1.79949
19 1GQ2 NAP 1.79949
20 1Z45 NAD 1.79949
21 1GY8 NAD 1.79949
22 1F8G NAD 1.82292
23 1L7E NAI 1.82292
24 3A4T SFG 1.82482
25 6C8R SAH 1.84697
26 5HXI FAD 1.84697
27 5HXI 5HN 1.84697
28 4PIO SAH 1.85759
29 4PIO AVI 1.85759
30 2A92 NAI 1.86916
31 5NMX FAD 1.88235
32 5NMX NAP 1.88235
33 6ECU SAH 1.89873
34 6ECW SAH 1.90476
35 2B99 RDL 1.92308
36 1EBF NAD 1.95531
37 3H9E NAD 2.02312
38 4JJF FE9 2.03488
39 3SQP FAD 2.05656
40 4M37 SAH 2.05656
41 4M38 SAH 2.05656
42 2B9W FAD 2.05656
43 1VJT NAD 2.05656
44 6C4N NAP 2.05656
45 4M00 SUC 2.05656
46 4N49 SAM 2.05656
47 2ZWA SAH 2.05656
48 4RVG TYD 2.05656
49 4RVG SAM 2.05656
50 6F3M NAD 2.05656
51 4ZNO SUC 2.08955
52 3C6K SPD 2.09974
53 3C6K MTA 2.09974
54 2Q1W NAD 2.1021
55 2Q1S NAI 2.12202
56 2EG5 SAH 2.15054
57 2BZG SAH 2.15517
58 2PT9 S4M 2.18069
59 5W7K SAH 2.24359
60 5W7M SAH 2.24359
61 3OU2 SAH 2.29358
62 3JWH SAH 2.30415
63 1VQW FAD 2.31362
64 2GVC FAD 2.31362
65 2Y6Q FAD 2.31362
66 5DNK SAH 2.31362
67 1D4D FAD 2.31362
68 3PT9 SAH 2.31362
69 4LWP SAH 2.31362
70 2GV8 FAD 2.31362
71 4KRG SAH 2.31362
72 1O0S NAI 2.31362
73 3QVP FAD 2.31362
74 5XNC MTA 2.31362
75 5THY SAH 2.31362
76 1U2Z SAH 2.31362
77 5THZ SAH 2.31362
78 2Y6Q I7T 2.31362
79 1P31 EPU 2.31362
80 2Q28 ADP 2.31362
81 1UWK NAD 2.31362
82 1UWK URO 2.31362
83 1R55 097 2.33645
84 2DT5 NAD 2.36967
85 1CF2 NAP 2.37389
86 1VDC FAD 2.4024
87 4KOA NDP 2.4024
88 1DSS NAD 2.4024
89 1TPY SAH 2.43902
90 5BJX NAD 2.45902
91 5BJX UDP 2.45902
92 2I7C AAT 2.4735
93 5FA8 SAM 2.48447
94 1F3L SAH 2.49221
95 2HNK SAH 2.51046
96 1YQZ FAD 2.51142
97 3EVG SAH 2.54545
98 3LCC SAH 2.55319
99 1FP2 SAH 2.55682
100 4B63 FAD 2.57069
101 4B63 NAP 2.57069
102 4B63 ORN 2.57069
103 1E1M NAP 2.57069
104 1E1M FAD 2.57069
105 1SC6 NAD 2.57069
106 2WET FAD 2.57069
107 5MQ6 NDP 2.57069
108 2FN1 PYR 2.57069
109 4D3F NAP 2.58065
110 1NYT NAP 2.58303
111 1RM4 NDP 2.67062
112 3G2O SAM 2.67559
113 4ZCC NAI 2.67857
114 4ZCC FAD 2.67857
115 1Z3C SA8 2.68456
116 3BGD SAH 2.69231
117 3BGD PM6 2.69231
118 4YAC NAI 2.6936
119 3LZW FAD 2.71084
120 1J0X NAD 2.71084
121 3LZW NAP 2.71084
122 6BQ6 TER 2.71903
123 3O7W SAM 2.72109
124 4XUC 43G 2.75229
125 4XUC SAM 2.75229
126 3OFK SAH 2.77778
127 1L1E SAH 2.78746
128 4ONQ SFG 2.80112
129 3ICT ADP 2.82776
130 3ICS ADP 2.82776
131 4C4A SAH 2.82776
132 5WP4 SAH 2.82776
133 2YG3 FAD 2.82776
134 2QA1 FAD 2.82776
135 3ICT FAD 2.82776
136 3ICR FAD 2.82776
137 3ICS FAD 2.82776
138 5WGR FAD 2.82776
139 4D7E FAD 2.82776
140 5OJL TXP 2.82776
141 4XQC NAD 2.82776
142 4XQC 13D 2.82776
143 1V8B NAD 2.82776
144 5UR0 NAD 2.86533
145 6AIN FAD 2.87081
146 3ZNN 4WL 2.88184
147 3ZNN FAD 2.88184
148 3WGT FAD 2.88184
149 3WGT QSC 2.88184
150 2D2I NAP 2.89474
151 1P77 ATR 2.94118
152 4PNE SAH 2.98013
153 3Q3C NAD 3.01003
154 1V6A TRE 3.01205
155 6GAS FAD 3.02115
156 5M58 SAH 3.04348
157 5WP5 SAH 3.05499
158 3AB1 FAD 3.05556
159 4IWN GEK 3.05677
160 3OJO NAD 3.08483
161 2IVD FAD 3.08483
162 3LXD FAD 3.08483
163 1HYH NAD 3.08483
164 5Y8L NAD 3.08483
165 5Y8L HUI 3.08483
166 1WDK NAD 3.08483
167 3U31 NAD 3.10345
168 1WP4 NDP 3.11419
169 2CVZ NDP 3.11419
170 4YAG NAI 3.11419
171 3LKZ SFG 3.11526
172 3KLJ FAD 3.11688
173 1DL5 SAH 3.15457
174 3FRH SAH 3.16206
175 3A06 NDP 3.19149
176 1XDS SAM 3.20856
177 1QZZ SAM 3.20856
178 1L5Y BEF 3.22581
179 5KVA SAM 3.23741
180 5JE0 SAH 3.23887
181 5JE0 AZ8 3.23887
182 3GEG NAD 3.23887
183 3B20 NAD 3.24484
184 3B1J NAD 3.24484
185 5FUB SAH 3.2641
186 2YX1 SFG 3.27381
187 6B74 BEN 3.29218
188 4RL4 PPV 3.30189
189 1HDG NAD 3.31325
190 5E1M SAH 3.3195
191 4E5N NAD 3.33333
192 2R4J 13P 3.3419
193 2R4J FAD 3.3419
194 3X0D SAH 3.3419
195 5ERG SAM 3.3419
196 2CDU FAD 3.3419
197 1ZGS XMM 3.3419
198 2CDU ADP 3.3419
199 1SOW NAD 3.35366
200 1ZGA SAH 3.36134
201 2ZIF SAM 3.367
202 1PL6 NAD 3.37079
203 4R81 FMN 3.39806
204 5LOG SAH 3.43348
205 1A5Z NAD 3.44828
206 6FLZ MMA 3.47222
207 1KYQ NAD 3.59897
208 5X68 FAD 3.59897
209 2RGJ FAD 3.59897
210 4AZW SAM 3.59897
211 4B4U NAP 3.63036
212 5Z21 NAI 3.63128
213 1N2X SAM 3.65448
214 3WV8 ATP 3.66972
215 5I7A 68Q 3.68098
216 2PV7 NAD 3.69128
217 5GM1 SAH 3.7037
218 6ECT SAM 3.73832
219 2DFV NAD 3.7464
220 2YYY NAP 3.79009
221 2AG8 NAP 3.80228
222 1GTE FAD 3.80488
223 4DD8 BAT 3.84615
224 3VC1 SAH 3.84615
225 1KNR FAD 3.85604
226 2HK9 ATR 3.85604
227 1LVL FAD 3.85604
228 5GSN FAD 3.85604
229 5GSN NAP 3.85604
230 1BZL GCG 3.85604
231 3NTA FAD 3.85604
232 5NA1 FAD 3.85604
233 5GSN MMZ 3.85604
234 4D04 FAD 3.85604
235 4D04 NAP 3.85604
236 3NTD FAD 3.85604
237 3NT6 FAD 3.85604
238 1LTH NAD 3.85604
239 1LVL NAD 3.85604
240 1BZL FAD 3.85604
241 5LV1 78T 3.85604
242 3P2E SAH 3.85604
243 3NJ4 NAD 3.85604
244 2DPM SAM 3.87324
245 4R6W SAH 3.87597
246 3I53 SAH 3.91566
247 1XTP SAI 3.93701
248 5N5D SAM 3.9823
249 3A27 SAM 4.04412
250 5Z20 NAI 4.05797
251 5TWB FAD 4.06977
252 6DNT NAD 4.06977
253 3WLE NAD 4.10557
254 2IZ1 ATR 4.11311
255 2JHP SAH 4.11311
256 3K7M FAD 4.11311
257 2E5V FAD 4.11311
258 4MOP 2H5 4.11311
259 1RSG FAD 4.11311
260 1YY5 FAD 4.11311
261 6H3O FAD 4.11311
262 2ZXI FAD 4.11311
263 3QOX SAH 4.11311
264 3DU4 KAP 4.11311
265 5ZDK ATP 4.11311
266 4YMH SAH 4.16667
267 2VT3 ATP 4.18605
268 3RKR NAP 4.19847
269 2XOC ADE 4.21456
270 3VYW SAM 4.22078
271 5YRI GLC GLC 4.22535
272 5YRJ BGC GLC 4.22535
273 5YRL GLC GLC 4.22535
274 5YRG BGC GLC 4.22535
275 5YRM BGC GLC 4.22535
276 4YUW 4JU 4.27632
277 4YUW S4M 4.27632
278 4OBW SAM 4.28016
279 1WY7 SAH 4.34783
280 4II2 ATP 4.37018
281 3X0V FAD 4.37018
282 4IV9 FAD 4.37018
283 4EMI NAD 4.37018
284 1XHC FAD 4.37018
285 4EMI FAD 4.37018
286 4UP3 FAD 4.37018
287 5Y77 FAD 4.37018
288 1MV8 NAD 4.37018
289 1PS9 FAD 4.37018
290 1I8T FAD 4.37018
291 1MUU NAD 4.37018
292 1PS9 NAP 4.37018
293 4UP3 NDP 4.37018
294 1EZ4 NAD 4.37018
295 2FK8 SAM 4.40252
296 1C0I BE2 4.40771
297 1C0I FAD 4.40771
298 1ZH8 NAP 4.41176
299 2EFJ SAH 4.42708
300 1NM5 NAD 4.4335
301 1GET NAP 4.44444
302 1GET FAD 4.44444
303 5OCM NAP 4.46735
304 4NTC FAD 4.47761
305 3DUW SAH 4.4843
306 6DUB SAH 4.5045
307 5F8F SFG 4.50928
308 2UYQ SAM 4.51613
309 1GV0 NAD 4.51613
310 1GUZ NAD 4.51613
311 2VYN NAD 4.53172
312 1GAD NAD 4.54545
313 4Y9D NAI 4.59016
314 1QO8 FAD 4.59364
315 4FZV SAM 4.60251
316 2O07 MTA 4.60526
317 2O07 SPD 4.60526
318 1G60 SAM 4.61538
319 4K5S FAD 4.62725
320 3SSO SAH 4.62725
321 4YRY FAD 4.62725
322 4YRY NAD 4.62725
323 5EB4 FAD 4.62725
324 5J5Z FAD 4.62725
325 4DSG UDP 4.62725
326 4DSG FAD 4.62725
327 6D6Y SAH 4.62725
328 6FHO FAD 4.62725
329 4K5S PM0 4.62725
330 5MZI FAD 4.62725
331 5MZI FYK 4.62725
332 3L9W GSH 4.62725
333 3L9W AMP 4.62725
334 4JK3 NAD 4.6332
335 2FKA BEF 4.65116
336 1KYZ SAH 4.65753
337 3QJ4 FAD 4.67836
338 3FGZ BEF 4.6875
339 1BXK NAD 4.78873
340 1RJD SAM 4.79042
341 1CER NAD 4.83384
342 1R18 SAH 4.84582
343 3T7S SAM 4.85075
344 4X9M FAD 4.88432
345 2Z3Y F2N 4.88432
346 4TXI FAD 4.88432
347 2BRY FAD 4.88432
348 3H5N ATP 4.88432
349 3OZ2 FAD 4.88432
350 2JB2 PHE 4.88432
351 2JB2 FAD 4.88432
352 4KRI SAH 4.88432
353 4EIP FAD 4.88432
354 4EIP K2C 4.88432
355 3ABI NAD 4.88432
356 5AOA PPI 4.8951
357 5GZ6 7C3 4.90798
358 5GZ6 NDP 4.90798
359 5JE8 NAD 4.96689
360 1XXR MAN 4.96894
361 3A25 SAM 4.98339
362 3QV1 NAD 5.04451
363 5V6F MAN BMA MAN 5.07246
364 5ZYN FAD 5.09554
365 1J49 NAD 5.1051
366 5O4J SAH 5.10949
367 5O4J PJL 5.10949
368 5O4J 9KH 5.10949
369 5E9W SAH 5.12821
370 1X14 NAD 5.14139
371 4USQ FAD 5.14139
372 3GDN HBX 5.14139
373 3GDN FAD 5.14139
374 2RAB NAD 5.14139
375 2RAB FAD 5.14139
376 4BV6 FAD 5.14139
377 3GD4 NAD 5.14139
378 3GD4 FAD 5.14139
379 3T31 DCQ 5.14139
380 3G5S FAD 5.14139
381 1LDN NAD 5.14139
382 1ZK7 FAD 5.14139
383 5MPT SAH 5.14139
384 1UP7 NAD 5.14139
385 5YB7 FAD 5.14139
386 5YB7 ORN 5.14139
387 2AQJ TRP 5.14139
388 2AQJ FAD 5.14139
389 3T31 FAD 5.14139
390 2OOR NAD 5.17241
391 5E72 SAM 5.20231
392 3MAG SAH 5.21173
393 3FPZ AHZ 5.21472
394 5D4V SAH 5.22388
395 5YF1 SFG 5.24862
396 5YF1 8V0 5.24862
397 6EL3 NAP 5.24934
398 3F8D FAD 5.26316
399 1QAN SAH 5.32787
400 1JNR FAD 5.33333
401 3L4S NAD 5.35714
402 3L4S 3PG 5.35714
403 1VBO MAN MAN MAN 5.36913
404 1VBO MAN 5.36913
405 3MCT SAH 5.38721
406 3IHG FAD 5.39846
407 4HA6 FAD 5.39846
408 4U8P UDP 5.39846
409 4U8P FDA 5.39846
410 4YKG FAD 5.39846
411 4YKG NAD 5.39846
412 2WPF WPF 5.39846
413 4Z24 FAD 5.39846
414 2WPF FAD 5.39846
415 1YKJ PHB 5.39846
416 1YKJ FAD 5.39846
417 2YVF NAD 5.39846
418 2YVF FAD 5.39846
419 5TUF TDC 5.39846
420 6ER9 NAP 5.39846
421 6ER9 FAD 5.39846
422 4C3Y FAD 5.39846
423 3Q9T FAY 5.39846
424 5AYV NAP 5.39846
425 3FG2 FAD 5.39846
426 4C3Y ANB 5.39846
427 5TUF FAD 5.39846
428 6A3J NAI 5.39846
429 1Q0S SAH 5.40541
430 2NXE SAM 5.51181
431 5C8W PCG 5.59441
432 2XVE FAD 5.60345
433 2XVF FAD 5.60345
434 2IID PHE 5.62249
435 2IID FAD 5.62249
436 5J60 FAD 5.625
437 5MBX SP5 5.65553
438 5MBX FAD 5.65553
439 4J36 FAD 5.65553
440 2NVK NAP 5.65553
441 4J36 1HR 5.65553
442 2DKH 3HB 5.65553
443 5BRT FAD 5.65553
444 4TM3 FAD 5.65553
445 2GMH FAD 5.65553
446 1X87 NAD 5.65553
447 2DKH FAD 5.65553
448 4AP3 NAP 5.65553
449 4AP3 FAD 5.65553
450 2NVK FAD 5.65553
451 5VN0 NAI 5.65553
452 1Q1R FAD 5.65553
453 5U8U FAD 5.65553
454 5VN0 FAD 5.65553
455 1PN0 IPH 5.65553
456 5BRT CH9 5.65553
457 1PN0 FAD 5.65553
458 2A8X FAD 5.65553
459 4M52 M52 5.65553
460 4M52 FAD 5.65553
461 3VY6 BGC BGC 5.67376
462 3AYI HCI 5.68655
463 3AYI FAD 5.68655
464 4Z0H NAD 5.68862
465 5N0J FAD 5.69801
466 5BUK FAD 5.77778
467 3GDH SAH 5.80913
468 2EJU SAH 5.82011
469 5T96 79J 5.84795
470 4JNA FAD 5.88235
471 6F97 FAD 5.9126
472 3E1T FAD 5.9126
473 2HQM FAD 5.9126
474 5G3U FDA 5.9126
475 5G3U ITW 5.9126
476 5EOW FAD 5.9126
477 1GPE FAD 5.9126
478 1BW9 NAD 5.9126
479 5ZBC FAD 5.9126
480 4JDR FAD 5.9126
481 3LAD FAD 5.9126
482 1BXG NAD 5.9126
483 1C1X NAD 5.9126
484 5AHO TLA 5.95238
485 3CTY FAD 5.95611
486 1RP0 AHZ 5.98592
487 5TQZ GLC 6
488 5N6C NAD 6
489 2PXX SAH 6.04651
490 3H8V ATP 6.16438
491 6FP4 E1T 6.16967
492 4REP FAD 6.16967
493 6FP4 FAD 6.16967
494 3B1F NAD 6.16967
495 6FDF SAH 6.16967
496 4TQK NAG 6.16967
497 5YEC ATP 6.17647
498 1RJW ETF 6.19469
499 2XYQ SAH 6.2069
500 5ZW3 SAH 6.22222
501 3V1Y NAD 6.23145
502 6GKV SAH 6.26781
503 6CEP NAD 6.28743
504 5MGZ SAH 6.35593
505 5K0A FAD 6.36364
506 3CIF NAD 6.40669
507 3CIF G3H 6.40669
508 1G55 SAH 6.41399
509 5MIT NAP 6.42202
510 5MIT FAD 6.42202
511 4OPC PGT 6.42674
512 4OPC FDA 6.42674
513 1Y8Q ATP 6.42674
514 2C7G FAD 6.42674
515 2C7G ODP 6.42674
516 5L95 AMP 6.45161
517 5NC9 8SZ 6.47773
518 1V59 FAD 6.48536
519 1V59 NAD 6.48536
520 3GWZ SAH 6.50407
521 2ZFU SAH 6.51163
522 5XFI NAG NAG BMA MAN MAN NAG GAL NAG 6.53595
523 4EMJ FAD 6.54206
524 5DWQ SFG 6.59026
525 5DX1 SFG 6.59026
526 5DXA SFG 6.59026
527 5DX8 SFG 6.59026
528 5DX0 SFG 6.59026
529 6AA8 NAD 6.62252
530 1I1N SAH 6.63717
531 4CNK FAD 6.64962
532 5TUK FAD 6.6838
533 1NAA 6FA 6.6838
534 6F7L FAD 6.6838
535 2JJQ SAH 6.6838
536 1NAA ABL 6.6838
537 5G48 1FL 6.68449
538 3BXO SAM 6.69456
539 5ZZ6 ADP 6.73077
540 5ZZ6 NAD 6.73077
541 1FL2 FAD 6.77419
542 3EGI ADP 6.79612
543 6B92 SAH 6.80272
544 5JCM FAD 6.94087
545 5JCM NAD 6.94087
546 5JCM ISD 6.94087
547 3UCL NAP 6.94087
548 3UCL CYH 6.94087
549 3UCL FAD 6.94087
550 1H82 GZZ 6.99153
551 1H82 FAD 6.99153
552 4POO SAM 7
553 4KIB SAH 7.0028
554 1ZQ9 SAM 7.01754
555 4NTD FAD 7.05882
556 1L7N ALF 7.109
557 4XB2 NDP 7.16418
558 4XB2 HSE 7.16418
559 2AOT SAH 7.19178
560 1JQD SAH 7.19178
561 1JQD HSM 7.19178
562 2RGH FAD 7.19794
563 3S5W FAD 7.19794
564 4USR FAD 7.19794
565 5HSA FAS 7.19794
566 5KMS FAD 7.19794
567 5KOX RFP 7.19794
568 5KOX FAD 7.19794
569 5KMS NAD 7.19794
570 1SQF SAM 7.19794
571 3S5W NAP 7.19794
572 1REO FAD 7.20165
573 2P41 SAH 7.21311
574 1O6Z NAD 7.26073
575 5LD5 NAD 7.26257
576 2VDV SAM 7.31707
577 3GGO NAI 7.32484
578 3UOY NAP 7.33945
579 3UOY FAD 7.33945
580 2PX8 SAH 7.43494
581 5TS5 FAD 7.43802
582 4OM8 NAD 7.44337
583 2RGO FAD 7.45501
584 5EZ7 FAD 7.45501
585 1COY FAD 7.45501
586 4RPL 3UC 7.45501
587 4RPL FAD 7.45501
588 5UAO FAD 7.45501
589 1COY AND 7.45501
590 2B4R NAD 7.53623
591 2B4R AES 7.53623
592 3VSE SAH 7.53769
593 3HDY GDU 7.55667
594 3HDY FDA 7.55667
595 3HDY FAD 7.55667
596 5FUI APY 7.57576
597 3C3Y SAH 7.59494
598 5BVA FAD 7.71208
599 4M73 SAH 7.71513
600 4M73 M72 7.71513
601 3MB5 SAM 7.84314
602 5YU3 PRO 7.84884
603 5YU3 NAD 7.84884
604 5OC1 FAD 7.9646
605 6GFK SAH 7.96813
606 1MO9 KPC 7.96915
607 1MO9 FAD 7.96915
608 3GF4 UPG 7.96915
609 3GF4 FAD 7.96915
610 4MIG G3F 7.96915
611 5HJM MTA 7.96915
612 1DJN ADP 7.96915
613 1O94 ADP 7.96915
614 1ONI BEZ 7.97101
615 3FZG SAM 8
616 1ZEM NAD 8.01527
617 2BQP GLC 8.11966
618 2G5C NAD 8.18505
619 1I9G SAM 8.21429
620 5TTJ FAD 8.22622
621 3CGD FAD 8.22622
622 3CGD COA 8.22622
623 3CGD NAD 8.22622
624 3CGB FAD 8.22622
625 5JWC FAD 8.22622
626 5TVF CGQ 8.23529
627 5BW4 SAM 8.2397
628 3G6N MET ALA SER 8.37696
629 1OMO NAD 8.38509
630 3VPH OXM 8.3871
631 3VPH NAD 8.3871
632 5J7X FAD 8.48329
633 5JJR SAH 8.48329
634 5OFW 9TW 8.52018
635 2XVM SAH 8.54271
636 2Q0L FAD 8.68167
637 2Q0L NAP 8.68167
638 3MQ2 SAH 8.7156
639 5X20 NAD 8.74036
640 4EUE NAI 8.74036
641 2FWP ICR 8.74317
642 1VE3 SAM 8.81057
643 3GRU AMP 8.81356
644 2BOS GLA GAL GLC NBU 8.82353
645 1C3M MAN MAN 8.84354
646 5ULP KB1 8.95522
647 2VVM FAD 8.99743
648 2VVL FAD 8.99743
649 2CUL FAD 9.05172
650 1HE1 AF3 9.09091
651 3DXY SAM 9.17431
652 4CQM NAP 9.1954
653 3GCZ SAM 9.21986
654 4YNU LGC 9.2545
655 4YNU FAD 9.2545
656 2F5Z FAD 9.375
657 1JQ3 AAT 9.45946
658 3QFA FAD 9.48276
659 1FEC FAD 9.51157
660 5BSZ SAH 9.51157
661 1QCI ADE 9.54198
662 9LDB NAD 9.63855
663 9LDT NAD 9.63855
664 4PLT NAI 9.66767
665 4PLT OXM 9.66767
666 3GFB NAD 9.71429
667 5N53 8NB 9.74359
668 4UP4 NDG 9.76864
669 4UP4 NAG 9.76864
670 1WS4 GYP 9.77444
671 1WS5 MMA 9.77444
672 1UGY GLA BGC 9.77444
673 1JOT GAL A2G 9.77444
674 1WS4 AMG 9.77444
675 1UGY GLA GLC 9.77444
676 1JAC AMG 9.77444
677 1UGW GAL 9.77444
678 3LLZ GAL NGA 9.77444
679 1KUJ MMA 9.77444
680 4AKB GAL 9.77444
681 1M26 GAL A2G 9.77444
682 4NEC SAH 9.84848
683 3CBG SAH 9.91379
684 3S1S SAH 10.0257
685 2HMT NAI 10.0257
686 2PWY SAH 10.0775
687 4BJZ P3A 10.1415
688 4BJZ FAD 10.1415
689 1E6E FAD 10.1562
690 1NV8 MEQ 10.2113
691 1NV8 SAM 10.2113
692 6GNC FAD 10.5442
693 4YSX FAD 10.6383
694 1XCL SAH 10.6383
695 1IM8 SAI 10.6557
696 2Q7V FAD 10.7692
697 4AT0 FAD 10.7969
698 3G89 SAM 10.8434
699 3TLJ SAH 10.992
700 1J5P NAD 11.0672
701 3FUU ADN 11.0701
702 3ITJ CIT 11.2426
703 3ITJ FAD 11.2426
704 3H2B SAH 11.33
705 4J56 FAD 11.4035
706 6F5Z SAH 11.4754
707 1Q9I FAD 11.5681
708 1Q9I TEO 11.5681
709 2WA2 SAM 11.9565
710 3RNM FAD 12.069
711 6GAR FAD 12.0823
712 6GNA FAD 12.1528
713 1P1C SAH 12.5628
714 4QTU SAM 12.5926
715 1I0B PEL 12.5964
716 1NW5 SAM 12.8527
717 1TH8 ADP 12.931
718 2NPX NAD 12.9754
719 2NPX FAD 12.9754
720 5FA5 MTA 13.1105
721 4GQB 0XU 13.1105
722 2Y4S BCD 13.3676
723 3NKS FAD 13.4172
724 1LOB MMA 13.4615
725 1NVM NAD 13.4615
726 1L3I SAH 13.5417
727 1LSS NAD 13.5714
728 2YVJ NAI 13.7615
729 2YVJ FAD 13.7615
730 6FA4 D1W 13.8728
731 2HJR APR 14.0244
732 1OFS SUC 14.5833
733 1JG3 ADN 14.8936
734 4MO2 FAD 14.91
735 4MO2 FDA 14.91
736 1EJ0 SAM 15
737 5JCA NDP 15.1671
738 5JCA FAD 15.1671
739 1TDF FAD 15.8228
740 1TDF NAP 15.8228
741 4GUT FAD 16.1954
742 4FWE FAD 16.1954
743 4IF4 BEF 16.3462
744 5NII FAD 16.4524
745 3HVJ 705 16.7421
746 5ODQ FAD 17.1429
747 4RDH AMP 17.7083
748 4RDI ATP 17.7083
749 3R51 MMA 18.125
750 2HO2 PRO PRO PRO PRO PRO PRO PRO PRO PRO LEU 18.4211
751 4D79 ATP 18.4783
752 4HSU FAD 20
753 5E8J SAH 20.4545
754 2NU5 NAG 21.3115
755 2HYR BGC GLC 21.3115
756 2GUD BMA 21.3115
757 2GUD MAN 21.3115
758 2GUC MAN 21.3115
759 2NUO BGC 21.3115
760 2GUE NAG 21.3115
761 2HYQ MAN MAN 21.3115
762 1RYI GOA 24.1645
763 1RYI FAD 24.1645
764 3AXB PRO 25.7069
765 3AXB FAD 25.7069
766 4RSL FAD 25.8427
767 3NYC IAR 26.5092
768 3NYC FAD 26.5092
769 5FJN FAD 26.7352
770 5FJN BE2 26.7352
771 4GUS FAD 28.5714
772 5I39 FAD 35.2185
773 2GAG FAD 38.0463
774 2GAG FOA 38.0463
775 2GAG NAD 38.0463
776 1TOQ AMG 45
Pocket No.: 2; Query (leader) PDB : 1ELI; Ligand: PYC; Similar sites found with APoc: 445
This union binding pocket(no: 2) in the query (biounit: 1eli.bio2) has 8 residues
No: Leader PDB Ligand Sequence Similarity
1 1UVC STE None
2 2UX9 FMN None
3 2Z3U CRR 1.02828
4 1RYD GLC 1.03359
5 5W75 SUC 1.28535
6 1FS5 TLA 1.50376
7 2II3 CAO 1.52672
8 5N0O SAM 1.54242
9 6GEW SFG 1.54242
10 6GEW SAH 1.54242
11 5KV9 I57 1.54242
12 1IYK MYA 1.54242
13 5KJW 53C 1.54242
14 2WSA 646 1.54242
15 2WSA MYA 1.54242
16 4WHZ 3NL 1.55844
17 4JR7 GNP 1.60428
18 1ZB6 GST 1.62866
19 5WA0 MSS 1.64384
20 6BHQ NAG NAG FUL BMA MAN MAN NAG GAL 1.78571
21 3IES M24 1.79949
22 1VA6 ADP 1.79949
23 1VA6 P2S 1.79949
24 4BQH 9VU 1.79949
25 3LVW GSH 1.79949
26 4NOS ITU 1.79949
27 4RF7 ARG 1.79949
28 5EFQ ADP 1.86567
29 2V1O COA 1.98676
30 2QPU QPU 2.05656
31 2QPU QPS 2.05656
32 5OMY 9YE 2.05656
33 2H8H H8H 2.05656
34 5YF9 NIO 2.0649
35 4GCZ FMN 2.07792
36 2IUW AKG 2.10084
37 6F4W FMC 2.14592
38 3NK7 SAM 2.16606
39 3EM0 CHD 2.17391
40 4RR7 A3S 2.20588
41 5BVE 4VG 2.21607
42 5H2U 1N1 2.24719
43 1UNB AKG 2.2508
44 2WQN ADP 2.25806
45 2OQ2 A3P 2.29885
46 3NZ1 3NY 2.29885
47 1F9V ADP 2.30548
48 1VJY 460 2.31023
49 3DLG GWE 2.31362
50 4UWJ MYA 2.31362
51 4UWJ 7L5 2.31362
52 5MU6 MYA 2.31362
53 5MU6 KFK 2.31362
54 4HWT 1B2 2.31362
55 1K97 ASP 2.31362
56 1K97 CIR 2.31362
57 1E5Q SHR 2.31362
58 3T1A 5MA 2.31362
59 2CER PGI 2.31362
60 3WV6 GAL BGC 2.36486
61 3PE2 E1B 2.37389
62 1ODM ASV 2.41692
63 5W4W 9WG 2.41692
64 4KBA 1QM 2.41692
65 4K55 H6P 2.41935
66 4NAT 2W5 2.5
67 4NAT ADP 2.5
68 4NBT NAD 2.5
69 1SDW IYT 2.54777
70 3CW9 AMP 2.57069
71 5C5H 4YB 2.57069
72 4RD0 GDP 2.57069
73 2ICY UPG 2.57069
74 4YWV SSN 2.57069
75 4U03 TLL 2.57069
76 4ITU 1HS 2.60223
77 3LGS ADE 2.62172
78 6B3V 7DQ 2.63158
79 5MM0 GDD 2.6738
80 5OJI ISN 2.69231
81 5OJI NAP 2.69231
82 5DEY 59T 2.6936
83 3ACL 3F1 2.7027
84 2P3V SRT 2.73438
85 1H8S AIC 2.77778
86 3G5D 1N1 2.7972
87 3MGB GHP 3MY 3FG GHP GHP OMY 3FG 2.82132
88 2HGS ADP 2.82776
89 1CT9 AMP 2.82776
90 4P8K FAD 2.82776
91 4P8K 38C 2.82776
92 2EQA AMP 2.84091
93 4CQE CQE 2.8777
94 1T57 FMN 2.91262
95 5DQ8 FLF 2.91667
96 5EJ2 NAD 2.92208
97 1V9A SAH 2.92887
98 5ZCT ANP 2.94118
99 5EW9 5VC 2.95203
100 2QHS OCA 2.95359
101 1I2L DCS 2.97398
102 1Z34 2FD 2.97872
103 4BVA T3 2.98507
104 1VL8 NAP 2.99625
105 4G31 0WH 3.01003
106 3OVR 5SP 3.07018
107 2YC5 6BC 3.07018
108 4MIB 28M 3.08483
109 3HKW IX6 3.08483
110 2OEG UPG 3.08483
111 4Z87 GDP 3.08483
112 1E7S NAP 3.11526
113 5H9P TD2 3.16456
114 1G1T SIA GAL MAG FUC 3.18471
115 4MVK ACE VAL PHE PHE ALA GLU ASP NH2 3.19149
116 3VPD ANP 3.20285
117 2P4T NAP 3.22581
118 5JJU AMP 3.23529
119 4O9S 2RY 3.25581
120 3ZF8 GDP 3.27869
121 2QHV OC9 3.33333
122 1ED4 IPU 3.3419
123 2QK4 ATP 3.3419
124 4GAH 0ET 3.34928
125 4NVP 7CH 3.34928
126 3D72 FAD 3.3557
127 4BCN T9N 3.43511
128 4I9A NCN 3.47222
129 4CNG SAH 3.52941
130 5Y72 DST 3.58209
131 1RZU ADP 3.59897
132 1REQ DCA 3.59897
133 3DAA PDD 3.61011
134 5ODY 9SK 3.62319
135 6MJF SAH 3.62694
136 5IVE 6E8 3.63636
137 1M15 ARG 3.64146
138 1M15 ADP 3.64146
139 2OJW ADP 3.64583
140 4BG4 ADP 3.65169
141 1MJJ HAL 3.65297
142 1MH5 HAL 3.65297
143 4CLI 5P8 3.66972
144 5ZJ5 NAI 3.7037
145 5NBW 8SK 3.73832
146 2Z93 END 3.75587
147 4L50 D8X 3.7594
148 2YKL NLD 3.77358
149 2QX0 APC 3.77358
150 4R2M ANP 3.79747
151 3E85 BSU 3.79747
152 3TM0 ANP 3.80228
153 3TM0 B31 3.80228
154 1NE7 AGP 3.80623
155 3GD9 GLC BGC BGC BGC 3.81471
156 2Z6D FMN 3.84615
157 1WOR RED 3.84615
158 3VC1 GST 3.84615
159 2C78 PUL 3.85604
160 3H0L ADP 3.85604
161 4WOE ADP 3.85604
162 1YKD CMP 3.85604
163 1GPM AMP 3.85604
164 3OQJ 3CX 3.89105
165 3N0Y APC 3.91061
166 5GWT SIN 3.95683
167 3BJE URA 4.01146
168 5UIU 8CG 4.02477
169 1NWW HPN 4.02685
170 2PTM CMP 4.0404
171 5AHW CMP 4.08163
172 1JIF CU BLM 4.09836
173 1I1E DM2 4.11311
174 1OC2 TDX 4.11311
175 1OC2 NAD 4.11311
176 4J7H TRH 4.11311
177 2C5S AMP 4.11622
178 2C29 NAP 4.1543
179 2C29 DQH 4.1543
180 2GU8 796 4.1543
181 1JYQ MAZ PTR PTM ASN 4.16667
182 1M5B BN1 4.18251
183 2J9D AMP 4.20168
184 2J9C ATP 4.20168
185 2J9D ADP 4.20168
186 5OCQ 9RN G4S 9RN G4S 4.21053
187 5XDT MB3 4.22078
188 5XDT ZI7 4.22078
189 4RDL FUC GAL NDG FUC 4.22078
190 5HCY 60D 4.22961
191 2B9H ADP 4.24929
192 5YYF PHQ GLN THR ALA ARG LYS NH2 FOA 4.25532
193 5LUN OGA 4.26136
194 5LUN ARG 4.26136
195 1N07 ADP 4.29448
196 1N07 FMN 4.29448
197 6GG9 FMN 4.32099
198 4WN5 MVC 4.34783
199 2PYW ADP 4.37018
200 2FY3 CHT 4.37018
201 1ERB ETR 4.37158
202 5ZFJ 9BF 4.40529
203 4K49 HFQ 4.41176
204 4ITH RCM 4.42177
205 5LHT TIH 4.42177
206 3H7J PPY 4.52675
207 2BKX F6R 4.54545
208 2YAK OSV 4.5614
209 4KWI 1TJ 4.56274
210 4KWI NAP 4.56274
211 4YQE PLQ 4.56853
212 4YQE FMN 4.56853
213 5XQW 8EU 4.60829
214 5DF1 58X 4.61957
215 5DF1 NAP 4.61957
216 4PU5 ANP 4.62725
217 3L9W FMN 4.62725
218 1IHU AF3 4.62725
219 1IHU ADP 4.62725
220 5EYP LOC 4.62725
221 5AE9 OKO 4.62725
222 4TW7 37K 4.6875
223 1O97 AMP 4.6875
224 1O97 FAD 4.6875
225 2ZHL NAG GAL GAL NAG 4.72973
226 4IJP 1EH 4.7486
227 4H2X G5A 4.85437
228 4H2W AMP 4.85437
229 4H2W 5GP 4.85437
230 5UL4 SAM 4.88432
231 5LGD PLM 4.88432
232 3TAY MN0 4.90798
233 1PR9 NAP 4.91803
234 2YNE YNE 4.94792
235 2YNE NHW 4.94792
236 4WW7 AMP 4.98084
237 4R38 RBF 5
238 6CDO ALA VAL GLY ILE GLY ALA VAL PHE 5.02283
239 5AYT L6Y 5.03145
240 2D6M LBT 5.03145
241 2G30 ALA ALA PHE 5.03876
242 4HIA FMN 5.11364
243 4RLE 2BA 5.12821
244 5A89 FMN 5.12821
245 5A89 ADP 5.12821
246 1P9P SAH 5.14139
247 3GYQ SAM 5.14706
248 4TWP AXI 5.16605
249 4QCK ASD 5.18135
250 4USI ATP 5.19481
251 5TBM 79A 5.21739
252 5NJI 8Z2 5.2795
253 1PN4 HDC 5.35714
254 5ML3 DL3 5.36913
255 3CF6 SP1 5.39846
256 1RWQ 5AP 5.39846
257 4ZU4 4TG 5.40541
258 5XVG 8FX 5.46075
259 2AG4 LP3 5.4878
260 2AG4 OLA 5.4878
261 3ZXR P3S 5.65553
262 3ZXR IQ1 5.65553
263 1GT4 UNA 5.66038
264 3QPB URA 5.67376
265 6GWR FEW 5.71429
266 1OUK 084 5.7377
267 5N87 N66 5.7508
268 4EMV 0R9 5.75221
269 3ZOD HQE 5.75916
270 3ZOD FMN 5.75916
271 1S4M LUM 5.80205
272 4P5Z Q7M 5.81717
273 3RIY NAD 5.86081
274 6GW4 CHO 5.86319
275 4B0T ADP 5.9126
276 1G51 AMP 5.9126
277 5YJS SAL 5.9126
278 2NZ2 CIR 5.9126
279 5CJ3 52G 5.92593
280 4K3H 1OM 5.9322
281 2VZ0 NAP 5.97015
282 2VZ0 D64 5.97015
283 5EWK P34 6
284 5F3I 5UJ 6.11111
285 1O51 ADP 6.14035
286 4QDF 30Q 6.15385
287 5LRT ADP 6.16967
288 3P7N FMN 6.20155
289 4LA7 A1O 6.21762
290 5L9N ATP 6.25
291 3TCT 3MI 6.29921
292 1HTW ADP 6.32911
293 2RDK MAN MAN 6.42202
294 3ZSN MIV 6.42674
295 1IR2 CAP 6.42857
296 2QHD DAO 6.55738
297 6E2B PT7 6.57895
298 5HQ0 LZ9 6.62252
299 5UR6 8KM 6.62983
300 1XVB BHL BHL 6.6838
301 2D1S SLU 6.6838
302 5Y1G AKB 6.70732
303 1JJE BYS 6.75676
304 2CYE COA 6.76692
305 3TA2 ATP 6.77966
306 2GJ5 VD3 6.79012
307 4WUJ FMN 6.80272
308 1NB9 ADP 6.80272
309 1NB9 RBF 6.80272
310 5J75 6GQ 6.81818
311 3JQ3 ADP 6.8306
312 3DLS ADP 6.86567
313 2ZMF CMP 6.87831
314 4QAC KK3 6.91244
315 4JWJ SAH 6.93069
316 2XVD AS6 6.95364
317 2JG1 ANP 6.9697
318 5D6T NGA 6.98529
319 4EOY ASN ASP TRP LEU LEU PRO SER TYR 7.03125
320 3G08 FEE 7.07071
321 3VRY B43 7.19794
322 2BO4 FLC 7.19794
323 3GNP SOG 7.19794
324 5LYH