Receptor
PDB id Resolution Class Description Source Keywords
3ICS 1.94 Å EC: 1.-.-.- CRYSTAL STRUCTURE OF PARTIALLY REDUCED BACILLUS ANTHRACIS CO BACILLUS ANTHRACIS PYRIDINE NUCLEOTIDE-DISULFIDE OXIDOREDUCTASE CLASS I RHODANCOENZYME A FLAVIN ADENINE DINUCLEOTIDE OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE AND CATALYTIC PROPERTIES OF BACIL ANTHRACIS COADR-RHD: IMPLICATIONS FOR FLAVIN-LINKED TRAFFICKING. BIOCHEMISTRY V. 48 9650 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP B:600;
Valid;
none;
submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
COA A:556;
B:556;
Valid;
Valid;
none;
none;
submit data
767.534 C21 H36 N7 O16 P3 S CC(C)...
FAD A:555;
B:555;
Valid;
Valid;
none;
none;
submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3ICS 1.94 Å EC: 1.-.-.- CRYSTAL STRUCTURE OF PARTIALLY REDUCED BACILLUS ANTHRACIS CO BACILLUS ANTHRACIS PYRIDINE NUCLEOTIDE-DISULFIDE OXIDOREDUCTASE CLASS I RHODANCOENZYME A FLAVIN ADENINE DINUCLEOTIDE OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE AND CATALYTIC PROPERTIES OF BACIL ANTHRACIS COADR-RHD: IMPLICATIONS FOR FLAVIN-LINKED TRAFFICKING. BIOCHEMISTRY V. 48 9650 2009
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 280 families.
1 3ICS - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 247 families.
1 3ICS - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 3ICS - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP; Similar ligands found: 435
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 ATP 0.9 1
3 A2D 0.895522 0.971831
4 AQP 0.887324 1
5 5FA 0.887324 1
6 AP5 0.884058 0.971831
7 B4P 0.884058 0.971831
8 BA3 0.869565 0.971831
9 AN2 0.84507 0.985915
10 M33 0.833333 0.958333
11 ACQ 0.826667 0.972222
12 A 0.823529 0.971429
13 AMP 0.823529 0.971429
14 ACP 0.821918 0.972222
15 AR6 0.810811 0.971831
16 APR 0.810811 0.971831
17 ANP 0.802632 0.972222
18 AD9 0.8 0.972222
19 AGS 0.8 0.945946
20 SAP 0.8 0.945946
21 ADX 0.783784 0.873418
22 CA0 0.783784 0.945205
23 TAT 0.779221 0.958904
24 AMP MG 0.774648 0.891892
25 50T 0.773333 0.958333
26 ABM 0.763889 0.917808
27 APC 0.763158 0.958904
28 PRX 0.763158 0.893333
29 ATF 0.759494 0.958904
30 A22 0.753086 0.985915
31 A12 0.743243 0.958904
32 AP2 0.743243 0.958904
33 ADP MG 0.736842 0.905405
34 SRA 0.736111 0.918919
35 ADQ 0.73494 0.945205
36 25L 0.732558 0.985915
37 ADP BEF 0.727273 0.881579
38 BEF ADP 0.727273 0.881579
39 5AL 0.725 0.931507
40 2A5 0.717949 0.918919
41 A1R 0.714286 0.907895
42 AU1 0.714286 0.972222
43 ADP PO3 0.708861 0.943662
44 PAP 0.708861 0.985714
45 ATR 0.708861 0.971429
46 SRP 0.707317 0.906667
47 7D3 0.706667 0.905405
48 25A 0.702381 0.971831
49 ATP MG 0.7 0.905405
50 OAD 0.697674 0.945205
51 RBY 0.6875 0.932432
52 ADV 0.6875 0.932432
53 00A 0.686047 0.883117
54 5SV 0.682353 0.848101
55 8QN 0.682353 0.931507
56 OOB 0.682353 0.931507
57 3OD 0.681818 0.945205
58 BIS 0.681818 0.933333
59 ADP ALF 0.674699 0.87013
60 ALF ADP 0.674699 0.87013
61 AMO 0.674419 0.932432
62 4AD 0.674419 0.92
63 PAJ 0.674419 0.884615
64 GAP 0.670732 0.893333
65 MAP 0.670588 0.945946
66 DLL 0.666667 0.931507
67 ANP MG 0.666667 0.894737
68 VO4 ADP 0.666667 0.931507
69 AHX 0.666667 0.896104
70 ADP VO4 0.666667 0.931507
71 PTJ 0.662921 0.896104
72 3UK 0.659091 0.918919
73 SON 0.658228 0.932432
74 LAD 0.651685 0.860759
75 WAQ 0.651685 0.883117
76 PR8 0.651685 0.85
77 ITT 0.65 0.943662
78 7D4 0.65 0.905405
79 G5P 0.648936 0.921053
80 RAB 0.647059 0.84507
81 ADN 0.647059 0.84507
82 XYA 0.647059 0.84507
83 TXA 0.644444 0.932432
84 1ZZ 0.644444 0.839506
85 ME8 0.644444 0.839506
86 NB8 0.644444 0.896104
87 FYA 0.644444 0.905405
88 6AD 0.642857 0.909091
89 ADP BMA 0.640449 0.918919
90 G3A 0.638298 0.921053
91 DAL AMP 0.632184 0.905405
92 AFH 0.631579 0.884615
93 9SN 0.630435 0.871795
94 GTA 0.625 0.886076
95 YAP 0.623656 0.894737
96 FA5 0.623656 0.906667
97 UP5 0.622449 0.92
98 XAH 0.617021 0.839506
99 AV2 0.616279 0.917808
100 AOC 0.615385 0.821918
101 48N 0.612245 0.896104
102 4UV 0.610526 0.894737
103 TXD 0.606061 0.907895
104 DND 0.606061 0.932432
105 NAX 0.606061 0.873418
106 NXX 0.606061 0.932432
107 NAI 0.606061 0.907895
108 6V0 0.606061 0.896104
109 5N5 0.605634 0.819444
110 5AS 0.604938 0.77907
111 A4P 0.60396 0.843373
112 DAT 0.60241 0.905405
113 A2R 0.602273 0.985915
114 TXE 0.6 0.907895
115 OMR 0.6 0.851852
116 4UU 0.597938 0.894737
117 A A 0.597826 0.944444
118 A4D 0.597222 0.819444
119 5CD 0.597222 0.805556
120 AP0 0.594059 0.896104
121 4TC 0.594059 0.896104
122 A3P 0.592593 0.971429
123 139 0.592233 0.873418
124 T5A 0.592233 0.841463
125 7D5 0.592105 0.878378
126 ATP A A A 0.589474 0.930556
127 LAQ 0.585859 0.839506
128 MYR AMP 0.585106 0.817073
129 YLP 0.58 0.819277
130 UPA 0.578431 0.907895
131 7DD 0.578313 0.985714
132 ADJ 0.576923 0.851852
133 3AM 0.576923 0.929577
134 COD 0.575472 0.811765
135 NAD 0.575472 0.931507
136 3AT 0.574713 0.971831
137 JB6 0.574468 0.883117
138 4UW 0.574257 0.860759
139 EP4 0.573333 0.753247
140 A2P 0.573171 0.957143
141 CNA 0.571429 0.932432
142 TYM 0.568627 0.906667
143 PPS 0.568182 0.873418
144 TYR AMP 0.56701 0.881579
145 DTA 0.565789 0.786667
146 M2T 0.565789 0.734177
147 AR6 AR6 0.565657 0.917808
148 A3D 0.564815 0.918919
149 3DH 0.564103 0.773333
150 G5A 0.563218 0.77907
151 YLB 0.563107 0.819277
152 YLC 0.563107 0.839506
153 AMP DBH 0.561224 0.893333
154 MTA 0.558442 0.773333
155 DTP 0.556818 0.905405
156 AHZ 0.554455 0.817073
157 NA7 0.553191 0.958904
158 IOT 0.552381 0.831325
159 7MD 0.55 0.8625
160 ZAS 0.55 0.766234
161 IMO 0.548781 0.929577
162 YLA 0.54717 0.819277
163 NAE 0.544643 0.894737
164 TAD 0.544554 0.884615
165 A5A 0.544444 0.807229
166 2AM 0.544304 0.943662
167 TSB 0.543478 0.819277
168 6RE 0.54321 0.759494
169 AYB 0.542056 0.809524
170 NAQ 0.539823 0.871795
171 V3L 0.539326 0.971831
172 ARG AMP 0.539216 0.829268
173 AF3 ADP 3PG 0.538462 0.8375
174 SSA 0.538462 0.8
175 LA8 ALF 3PG 0.538462 0.8375
176 ALF ADP 3PG 0.538462 0.8375
177 ZID 0.535088 0.918919
178 LPA AMP 0.533981 0.817073
179 54H 0.532609 0.788235
180 52H 0.532609 0.77907
181 VMS 0.532609 0.788235
182 BTX 0.53211 0.841463
183 J7C 0.53012 0.769231
184 A3N 0.53012 0.786667
185 5X8 0.528736 0.763158
186 BT5 0.527273 0.831325
187 5CA 0.526882 0.8
188 53H 0.526882 0.77907
189 ARU 0.526316 0.860759
190 EAD 0.525862 0.873418
191 RGT 0.525253 0.958904
192 OVE 0.52439 0.905405
193 S4M 0.52381 0.666667
194 7DT 0.522727 0.985714
195 GDP 0.522222 0.92
196 DDS 0.522222 0.878378
197 AVV 0.521277 0.896104
198 NDE 0.521008 0.932432
199 7MC 0.518868 0.841463
200 DSH 0.518072 0.725
201 MAO 0.517647 0.759036
202 LSS 0.515789 0.761364
203 DSZ 0.515789 0.8
204 NSS 0.515789 0.8
205 P5A 0.515464 0.744444
206 DZD 0.513514 0.884615
207 NVA LMS 0.510417 0.761364
208 12D 0.509615 0.785714
209 NAD IBO 0.509091 0.87013
210 M24 0.508772 0.85
211 YLY 0.508772 0.809524
212 P1H 0.508333 0.851852
213 5AD 0.506849 0.746479
214 GJV 0.505882 0.75
215 LEU LMS 0.505155 0.761364
216 G A A A 0.504505 0.871795
217 4TA 0.504505 0.807229
218 NAJ PZO 0.504425 0.848101
219 KAA 0.5 0.752809
220 NDC 0.5 0.871795
221 7D7 0.5 0.743243
222 71V 0.5 0.907895
223 A3G 0.5 0.8
224 128 0.5 0.776471
225 GSU 0.5 0.77907
226 N0B 0.495726 0.819277
227 NJP 0.495495 0.945946
228 ODP 0.495495 0.909091
229 2SA 0.494624 0.932432
230 6C6 0.494505 0.881579
231 SFG 0.494382 0.75
232 0WD 0.491071 0.921053
233 YSA 0.490196 0.77907
234 PO4 PO4 A A A A PO4 0.489796 0.902778
235 6IA 0.48913 0.8375
236 SAM 0.48913 0.690476
237 A7D 0.488636 0.776316
238 6FA 0.488 0.841463
239 FB0 0.487805 0.804598
240 NAJ PYZ 0.487179 0.85
241 IDP 0.483516 0.918919
242 A5D 0.483516 0.786667
243 SA8 0.483516 0.707317
244 MHZ 0.483146 0.697674
245 PGS 0.483146 0.883117
246 D5M 0.482353 0.878378
247 DA 0.482353 0.878378
248 NEC 0.482353 0.746667
249 NIA 0.481928 0.822785
250 Y3J 0.480519 0.726027
251 FAD 0.480315 0.851852
252 FAS 0.480315 0.851852
253 FDA 0.48 0.833333
254 N6P 0.479592 0.915493
255 GGZ 0.479167 0.825
256 SAH 0.478261 0.74359
257 SAI 0.478261 0.734177
258 NPW 0.477477 0.886076
259 NDP 0.477477 0.921053
260 AAM 0.476744 0.971429
261 AMZ 0.47561 0.916667
262 C2R 0.47561 0.90411
263 A A A 0.474747 0.905405
264 GTP 0.473684 0.92
265 U A G G 0.473684 0.883117
266 SMM 0.473684 0.686047
267 TXP 0.473214 0.921053
268 NZQ 0.473214 0.909091
269 A3S 0.47191 0.810811
270 AMP NAD 0.470588 0.881579
271 SFD 0.46875 0.734043
272 AIR 0.468354 0.901408
273 AAT 0.468085 0.707317
274 EEM 0.468085 0.690476
275 Z5A 0.466667 0.77907
276 7C5 0.466667 0.818182
277 J7V 0.466667 0.833333
278 62F 0.465649 0.8625
279 FAY 0.462121 0.8625
280 ETB 0.461538 0.833333
281 DCA 0.461538 0.823529
282 A3T 0.461538 0.821918
283 A6D 0.46 0.722892
284 A U 0.459459 0.87013
285 6K6 0.459184 0.930556
286 GEK 0.459184 0.7375
287 RFL 0.458647 0.821429
288 S7M 0.458333 0.690476
289 NAP 0.458333 0.945205
290 4YB 0.457944 0.761364
291 WSA 0.454545 0.788235
292 TAP 0.454545 0.907895
293 FNK 0.454545 0.804598
294 COA 0.453782 0.823529
295 0T1 0.453782 0.823529
296 101 0.453488 0.878378
297 XNP 0.452174 0.873418
298 NA0 0.45082 0.932432
299 7RP 0.448276 0.928571
300 GP3 0.446809 0.921053
301 TM1 0.446602 0.77381
302 APU 0.446429 0.894737
303 PUA 0.445378 0.884615
304 V1N 0.443396 0.917808
305 7RA 0.443182 0.957747
306 30N 0.442623 0.752688
307 CAO 0.442623 0.795455
308 AMX 0.442623 0.833333
309 COS 0.442623 0.804598
310 ACK 0.44186 0.861111
311 QQY 0.44186 0.815789
312 649 0.441441 0.744444
313 0UM 0.44 0.698795
314 NHD 0.439655 0.905405
315 CMX 0.439024 0.823529
316 SCO 0.439024 0.823529
317 GCP 0.438776 0.896104
318 8BR 0.438202 0.906667
319 GNH 0.4375 0.907895
320 3AD 0.4375 0.805556
321 62X 0.435644 0.666667
322 ACO 0.435484 0.795455
323 FCX 0.435484 0.795455
324 FAM 0.435484 0.804598
325 GNP 0.434343 0.896104
326 NMX 0.433071 0.76087
327 MGP 0.43299 0.884615
328 PLP AAD 0.432203 0.741573
329 26A 0.432099 0.763158
330 HAX 0.432 0.804598
331 K15 0.431373 0.682353
332 DG1 0.430894 0.921053
333 1DG 0.430894 0.921053
334 QQX 0.430233 0.805195
335 2VA 0.430108 0.8
336 S8M 0.43 0.759494
337 2MC 0.429688 0.769231
338 3KK 0.428571 0.804598
339 6G0 0.428571 0.884615
340 FYN 0.428571 0.823529
341 P5F 0.428571 0.823529
342 NAD BBN 0.428571 0.841463
343 U G A 0.427481 0.839506
344 AS 0.426966 0.833333
345 FAI 0.426966 0.916667
346 RMB 0.426966 0.873239
347 1RB 0.425287 0.885714
348 MCD 0.425197 0.804598
349 OXK 0.425197 0.804598
350 COK 0.425197 0.804598
351 CA6 0.425197 0.729167
352 SOP 0.425197 0.804598
353 G1R 0.424242 0.907895
354 CC5 0.423077 0.816901
355 SXZ 0.423077 0.710843
356 F2N 0.422535 0.813953
357 NAD CJ3 0.422222 0.811765
358 ANZ 0.422018 0.8
359 CMC 0.421875 0.804598
360 CO6 0.421875 0.804598
361 1VU 0.421875 0.795455
362 ZDA 0.421053 0.864865
363 GDD 0.420561 0.884615
364 GKE 0.420561 0.884615
365 GDC 0.420561 0.884615
366 NFD 0.420168 0.883117
367 GSP 0.42 0.873418
368 D3Y 0.42 0.789474
369 MC4 0.419847 0.76087
370 3L1 0.419753 0.773333
371 3D1 0.419753 0.773333
372 FA9 0.41958 0.864198
373 5GP 0.419355 0.906667
374 G 0.419355 0.906667
375 KB1 0.419048 0.698795
376 SCD 0.418605 0.823529
377 CAJ 0.418605 0.804598
378 2BA 0.417582 0.915493
379 CMP 0.417582 0.901408
380 SO8 0.416667 0.789474
381 N01 0.416667 0.905405
382 VRT 0.416667 0.769231
383 3HC 0.415385 0.813953
384 A1S 0.415385 0.804598
385 BCO 0.415385 0.804598
386 IVC 0.415385 0.813953
387 MLC 0.415385 0.804598
388 1HE 0.415385 0.786517
389 NMN AMP PO4 0.415254 0.87013
390 2FA 0.414634 0.813333
391 MGO 0.414141 0.860759
392 3NZ 0.413462 0.782051
393 MCA 0.412214 0.795455
394 CAA 0.412214 0.813953
395 YE1 0.412214 0.813953
396 COO 0.412214 0.804598
397 GAV 0.411765 0.884615
398 P2P 0.411111 0.902778
399 JLN 0.411111 0.890411
400 ZZB 0.410256 0.77381
401 CNV FAD 0.410072 0.793103
402 SCA 0.409091 0.804598
403 RP1 0.409091 0.842105
404 103 0.409091 0.837838
405 2CP 0.409091 0.795455
406 SP1 0.409091 0.842105
407 PAX 0.408 0.829268
408 FAD NBT 0.407143 0.75
409 NVA 2AD 0.40625 0.74359
410 COW 0.406015 0.795455
411 BYC 0.406015 0.804598
412 2KQ 0.406015 0.786517
413 COF 0.406015 0.786517
414 3CP 0.406015 0.804598
415 IRC 0.406015 0.813953
416 1GZ 0.406015 0.795455
417 HGG 0.406015 0.804598
418 CA8 0.406015 0.729167
419 G2P 0.405941 0.884615
420 SLU 0.404959 0.770115
421 U A C C 0.404959 0.858974
422 RBZ 0.404494 0.849315
423 1CZ 0.404412 0.795455
424 BCA 0.402985 0.795455
425 FAQ 0.402985 0.804598
426 4CA 0.402985 0.795455
427 MTP 0.402439 0.730769
428 8OD 0.402062 0.945205
429 CO7 0.401515 0.804598
430 DAL FAD PER 0.401408 0.809524
431 G2R 0.4 0.884615
432 HXC 0.4 0.786517
433 ENQ 0.4 0.916667
434 GMV 0.4 0.896104
435 GRA 0.4 0.804598
Ligand no: 2; Ligand: COA; Similar ligands found: 197
No: Ligand ECFP6 Tc MDL keys Tc
1 COA 1 1
2 0T1 0.894737 0.976744
3 DCA 0.893805 0.954023
4 COS 0.887931 0.977012
5 ETB 0.877193 0.920455
6 CAO 0.871795 0.965909
7 AMX 0.871795 0.988235
8 30N 0.871795 0.913979
9 CMX 0.864407 0.976744
10 SCO 0.864407 0.976744
11 FAM 0.857143 0.954545
12 ACO 0.857143 0.965909
13 FCX 0.857143 0.94382
14 HAX 0.85 0.954545
15 3KK 0.842975 0.977012
16 FYN 0.842975 1
17 CA6 0.836066 0.885417
18 SOP 0.836066 0.977012
19 MCD 0.836066 0.954545
20 COK 0.836066 0.977012
21 OXK 0.836066 0.977012
22 NMX 0.829268 0.903226
23 CO6 0.829268 0.977012
24 CMC 0.829268 0.977012
25 1VU 0.829268 0.965909
26 CAJ 0.822581 0.954545
27 SCD 0.822581 0.976744
28 2MC 0.822581 0.934066
29 2CP 0.81746 0.965909
30 BCO 0.816 0.977012
31 3HC 0.816 0.988372
32 1HE 0.816 0.955056
33 MLC 0.816 0.977012
34 A1S 0.816 0.977012
35 IVC 0.816 0.988372
36 COD 0.810345 0.988235
37 CAA 0.809524 0.988372
38 COO 0.809524 0.977012
39 MCA 0.809524 0.965909
40 YE1 0.809524 0.965517
41 SCA 0.80315 0.977012
42 MC4 0.80315 0.923913
43 IRC 0.796875 0.988372
44 3CP 0.796875 0.977012
45 CA8 0.796875 0.885417
46 BYC 0.796875 0.977012
47 COW 0.796875 0.965909
48 2KQ 0.796875 0.955056
49 COF 0.796875 0.955056
50 HGG 0.796875 0.977012
51 1GZ 0.796875 0.965909
52 4CA 0.790698 0.965909
53 FAQ 0.790698 0.977012
54 BCA 0.790698 0.965909
55 GRA 0.784615 0.977012
56 HXC 0.784615 0.955056
57 1CV 0.781955 0.977012
58 TGC 0.778626 0.965909
59 1CZ 0.772727 0.965909
60 CO8 0.772727 0.955056
61 S0N 0.772727 0.954545
62 2NE 0.772727 0.955056
63 CIC 0.772727 0.977012
64 0FQ 0.766917 0.977012
65 ST9 0.766917 0.955056
66 4CO 0.766917 0.965909
67 UCC 0.766917 0.955056
68 MFK 0.766917 0.955056
69 DCC 0.766917 0.955056
70 MYA 0.766917 0.955056
71 5F9 0.766917 0.955056
72 01A 0.761194 0.934066
73 0ET 0.761194 0.955056
74 CS8 0.755556 0.944444
75 WCA 0.755556 0.955056
76 4KX 0.75 0.944444
77 UOQ 0.75 0.955056
78 NHW 0.75 0.955056
79 HDC 0.75 0.955056
80 NHM 0.75 0.955056
81 HFQ 0.744526 0.955056
82 MRS 0.744526 0.955056
83 MRR 0.744526 0.955056
84 DAK 0.73913 0.944444
85 YNC 0.73913 0.965909
86 8Z2 0.733813 0.944444
87 NHQ 0.723404 0.988372
88 1HA 0.713287 0.955056
89 01K 0.708333 0.977012
90 COT 0.703448 0.977012
91 CCQ 0.695652 0.934066
92 CA3 0.693878 0.977012
93 CA5 0.671053 0.934066
94 UCA 0.666667 0.955056
95 93P 0.666667 0.965909
96 CO7 0.664234 0.977012
97 93M 0.64557 0.965909
98 OXT 0.634146 0.913979
99 5TW 0.607143 0.913979
100 4BN 0.607143 0.913979
101 PAP 0.603604 0.811765
102 JBT 0.598837 0.894737
103 BSJ 0.592814 0.944444
104 HMG 0.581081 0.943182
105 COA MYR 0.573333 0.922222
106 PLM COA 0.573333 0.922222
107 COA PLM 0.573333 0.922222
108 A3P 0.54955 0.8
109 PPS 0.547009 0.752688
110 0WD 0.521739 0.788889
111 RFC 0.490683 0.955056
112 SFC 0.490683 0.955056
113 191 0.490196 0.865979
114 3AM 0.482143 0.788235
115 PTJ 0.48062 0.872093
116 ACE SER ASP ALY THR NH2 COA 0.478261 0.932584
117 4PS 0.477477 0.682353
118 A22 0.468254 0.813953
119 A2D 0.465517 0.802326
120 PUA 0.462585 0.820225
121 PAJ 0.460938 0.883721
122 AGS 0.459016 0.806818
123 SAP 0.459016 0.806818
124 ATR 0.459016 0.8
125 3OD 0.458015 0.825581
126 ADP 0.453782 0.823529
127 A2R 0.448819 0.813953
128 BA3 0.445378 0.802326
129 NA7 0.442748 0.858824
130 OAD 0.442748 0.825581
131 ATP 0.442623 0.823529
132 AP5 0.441667 0.802326
133 B4P 0.441667 0.802326
134 APR 0.439024 0.802326
135 5FA 0.439024 0.823529
136 2A5 0.439024 0.847059
137 AQP 0.439024 0.823529
138 AR6 0.439024 0.802326
139 AN2 0.438017 0.813953
140 48N 0.435714 0.808989
141 M33 0.434426 0.813953
142 SRP 0.429688 0.837209
143 ANP 0.428571 0.804598
144 ADQ 0.427481 0.804598
145 YLB 0.426573 0.908046
146 YLP 0.425532 0.886364
147 5AL 0.425197 0.813953
148 7D3 0.425 0.793103
149 AD9 0.424 0.804598
150 APU 0.423611 0.786517
151 7D4 0.422764 0.793103
152 CA0 0.422764 0.804598
153 25L 0.422222 0.813953
154 ATF 0.421875 0.795455
155 NJP 0.421769 0.806818
156 A2P 0.421488 0.788235
157 A A A 0.421053 0.813953
158 8QN 0.419847 0.813953
159 PNS 0.419643 0.682353
160 ACP 0.419355 0.825581
161 NDP 0.417808 0.788889
162 ACQ 0.417323 0.825581
163 A1R 0.416667 0.882353
164 ATP A A A 0.416058 0.770115
165 A 0.415254 0.8
166 AMP 0.415254 0.8
167 FYA 0.414815 0.813953
168 1ZZ 0.414815 0.842697
169 TXA 0.414815 0.816092
170 NB8 0.414815 0.808989
171 AHX 0.413534 0.829545
172 DLL 0.413534 0.793103
173 00A 0.413534 0.758242
174 PAX 0.412903 0.793478
175 OMR 0.409722 0.853933
176 25A 0.409091 0.802326
177 OOB 0.409091 0.793103
178 NPW 0.408163 0.822222
179 WAQ 0.407407 0.860465
180 A A 0.407407 0.781609
181 TAT 0.40625 0.816092
182 4AD 0.406015 0.827586
183 AMO 0.406015 0.837209
184 YAP 0.405797 0.806818
185 FA5 0.405797 0.816092
186 TXP 0.405405 0.829545
187 ABM 0.404959 0.781609
188 PRX 0.404762 0.825581
189 ME8 0.404412 0.842697
190 BIS 0.404412 0.818182
191 AFH 0.404255 0.78022
192 J7V 0.403846 0.778947
193 NAI 0.402778 0.777778
194 ODP 0.402685 0.78022
195 ADX 0.4 0.752688
196 SRA 0.4 0.784091
197 AU1 0.4 0.804598
Ligand no: 3; Ligand: FAD; Similar ligands found: 119
No: Ligand ECFP6 Tc MDL keys Tc
1 FAS 1 1
2 FAD 1 1
3 FAY 0.859259 0.9875
4 RFL 0.852941 0.963855
5 6FA 0.794118 0.987654
6 DAL FAD PER 0.772414 0.951807
7 FAE 0.751773 0.987654
8 SFD 0.651007 0.860215
9 FDA 0.641892 0.906977
10 FNK 0.602564 0.876405
11 62F 0.572327 0.939024
12 F2N 0.566265 0.886364
13 FMN 0.543307 0.876543
14 FA9 0.526316 0.939759
15 6YU 0.516304 0.860215
16 CNV FAD 0.511905 0.908046
17 P6G FDA 0.511628 0.908046
18 FAD NBT 0.508876 0.83871
19 A2D 0.504065 0.875
20 P5F 0.491329 0.941176
21 FAD CNX 0.488506 0.8125
22 APR 0.488372 0.851852
23 AR6 0.488372 0.851852
24 AGS 0.484615 0.811765
25 SAP 0.484615 0.811765
26 M33 0.484375 0.864198
27 BA3 0.484127 0.875
28 FAD NBA 0.480663 0.802083
29 ATP 0.48062 0.851852
30 B4P 0.480315 0.875
31 ADP 0.480315 0.851852
32 AP5 0.480315 0.875
33 ANP 0.477273 0.831325
34 AQP 0.476923 0.851852
35 5FA 0.476923 0.851852
36 48N 0.469388 0.902439
37 OAD 0.467626 0.876543
38 GTA 0.465753 0.892857
39 AN2 0.465116 0.841463
40 AD9 0.462121 0.831325
41 3OD 0.460993 0.876543
42 RBF 0.460938 0.790123
43 FB0 0.460606 0.835165
44 139 0.460526 0.858824
45 AP0 0.46 0.835294
46 A22 0.459854 0.864198
47 ACP 0.458015 0.853659
48 8QN 0.456522 0.864198
49 PRX 0.454545 0.831325
50 A1R 0.453237 0.86747
51 G3A 0.452055 0.902439
52 T5A 0.45098 0.872093
53 G5P 0.44898 0.902439
54 ATF 0.448529 0.821429
55 50T 0.44697 0.819277
56 ACQ 0.444444 0.853659
57 PAJ 0.442857 0.847059
58 ADQ 0.442857 0.853659
59 5AL 0.441176 0.864198
60 ADX 0.439394 0.775281
61 CA0 0.439394 0.853659
62 A4P 0.437909 0.831461
63 25L 0.4375 0.864198
64 P33 FDA 0.436464 0.817204
65 5SV 0.435714 0.793103
66 TXE 0.434211 0.890244
67 OMR 0.434211 0.818182
68 ABM 0.434109 0.829268
69 A 0.433071 0.82716
70 AMP 0.433071 0.82716
71 4AD 0.432624 0.855422
72 ADJ 0.432258 0.818182
73 BIS 0.430556 0.802326
74 SRA 0.429688 0.788235
75 AFH 0.42953 0.825581
76 TXD 0.427632 0.890244
77 NXX 0.427632 0.865854
78 UP5 0.427632 0.878049
79 DND 0.427632 0.865854
80 6V0 0.427632 0.857143
81 SRP 0.42446 0.843373
82 PR8 0.423611 0.837209
83 TAT 0.423358 0.821429
84 AMO 0.422535 0.865854
85 PTJ 0.42069 0.835294
86 FYA 0.42069 0.864198
87 TXA 0.42069 0.865854
88 CNA 0.420382 0.865854
89 00A 0.41958 0.823529
90 AHX 0.41958 0.835294
91 MAP 0.41844 0.811765
92 NAI 0.418301 0.845238
93 AU1 0.41791 0.831325
94 AP2 0.416667 0.843373
95 A12 0.416667 0.843373
96 25A 0.415493 0.851852
97 AMP MG 0.415385 0.785714
98 COD 0.415094 0.842697
99 ADP BEF 0.414815 0.77907
100 BEF ADP 0.414815 0.77907
101 4TC 0.412903 0.879518
102 APC 0.411765 0.843373
103 NB8 0.410959 0.835294
104 ME8 0.410959 0.806818
105 1ZZ 0.410959 0.806818
106 4UW 0.409091 0.825581
107 NAX 0.409091 0.837209
108 RBY 0.408759 0.843373
109 ADV 0.408759 0.843373
110 ADP MG 0.407407 0.797619
111 P1H 0.405882 0.818182
112 OOB 0.405594 0.864198
113 A A 0.40411 0.829268
114 LAD 0.40411 0.825581
115 UPA 0.403846 0.86747
116 4UU 0.401316 0.833333
117 A3D 0.401235 0.876543
118 DLL 0.4 0.864198
119 XAH 0.4 0.806818
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3ICS; Ligand: ADP; Similar sites found: 504
This union binding pocket(no: 1) in the query (biounit: 3ics.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2BOS GLA GAL GLC NBU 0.005739 0.42635 None
2 2BOS GLA GAL GLC 0.009827 0.41314 None
3 2DKH 3HB 0.0000001066 0.68529 1.02041
4 2DKH FAD 0.000000064 0.68529 1.02041
5 3CMC NAD 0.000018 0.59818 1.1976
6 1H9A NAP 0.0007964 0.48277 1.23711
7 1PHP ADP 0.00907 0.41504 1.26904
8 1H82 GZZ 0.0000007209 0.66875 1.27119
9 1H82 FAD 0.000000699 0.66511 1.27119
10 2ZXI FAD 0.0000004992 0.42065 1.36054
11 1U2Z SAH 0.01535 0.40561 1.38568
12 1NVT NAP 0.0001124 0.51025 1.39373
13 1SB8 NAD 0.0002593 0.52238 1.42045
14 1SB8 UD2 0.0003076 0.52238 1.42045
15 1RE8 BD2 0.03204 0.4106 1.42857
16 1UP7 NAD 0.0002598 0.49453 1.43885
17 4EIP FAD 0.00000009152 0.69668 1.45719
18 4EIP K2C 0.0000002033 0.68174 1.45719
19 5UAO FAD 0.000002037 0.61878 1.47874
20 3V1U NAD 0.002796 0.44451 1.51515
21 5WGR FAD 0.0000001568 0.40647 1.53061
22 1NFQ NAI 0.008403 0.42925 1.53846
23 5DNK SAH 0.00595 0.40461 1.62455
24 2J5V PCA 0.00241 0.44525 1.63488
25 1H2B NAJ 0.000002065 0.41615 1.67131
26 3Q3C NAD 0.0003874 0.48433 1.67224
27 2ZIF SAM 0.008167 0.41377 1.6835
28 4MIG G3F 0.00000004864 0.71673 1.70068
29 5EOW FAD 0.0000001617 0.43371 1.70068
30 5N2I NAP 0.0002012 0.49206 1.72414
31 3CBG SAH 0.0009282 0.42192 1.72414
32 2B4R NAD 0.00000058 0.44136 1.73913
33 2B4R AES 0.000002652 0.42806 1.73913
34 3UCL NAP 0.0000004229 0.68718 1.7452
35 3UCL FAD 0.0000003716 0.68718 1.7452
36 3UCL CYH 0.0000003716 0.68718 1.7452
37 3E1T FAD 0.00000004109 0.40872 1.75781
38 1KOL NAD 0.0000034 0.60442 1.75879
39 3KB6 NAD 0.0000129 0.41987 1.79641
40 1L7E NAI 0.0005586 0.47667 1.82292
41 1F8G NAD 0.0004285 0.40603 1.82292
42 3X0D SAH 0.0007349 0.46328 1.87075
43 2FZW NAD 0.00001713 0.57867 1.87668
44 3OA2 NAD 0.00005681 0.40094 1.88679
45 3CIF NAD 0.0000003444 0.64078 1.94986
46 3CIF G3H 0.000003089 0.60488 1.94986
47 1BXG NAD 0.000002335 0.59586 1.96629
48 1BW9 NAD 0.00000175 0.48673 1.96629
49 1C1X NAD 0.000002146 0.45148 1.97183
50 1I2B NAD 0.0003773 0.51954 1.9802
51 1I2B USQ 0.04413 0.43516 1.9802
52 1I2B UPG 0.04413 0.43516 1.9802
53 2ZB3 NDP 0.02032 0.40653 1.983
54 3G89 SAM 0.002995 0.41662 2.00803
55 1XHL NDP 0.006322 0.43541 2.0202
56 3H9E NAD 0.000001372 0.45221 2.02312
57 1K3T BRZ 0.0002057 0.51072 2.04082
58 4TXI FAD 0.000000003291 0.48802 2.04082
59 1PR9 NAP 0.005076 0.44137 2.04918
60 2AOT SAH 0.002488 0.43197 2.05479
61 3V1Y NAD 0.0000001471 0.4834 2.07715
62 2RGH FAD 0.00000003825 0.70959 2.10158
63 1J49 NAD 0.000001203 0.61414 2.1021
64 1ZQ9 SAM 0.0008189 0.41864 2.10526
65 1RP0 AHZ 0.000000001116 0.77045 2.11268
66 2VYN NAD 0.0000002183 0.46253 2.1148
67 1G0N NDP 0.0002644 0.51192 2.12014
68 1G0N PHH 0.0003217 0.51116 2.12014
69 1GAD NAD 0.000005649 0.57719 2.12121
70 1CDO NAD 0.00002125 0.54919 2.13904
71 1GQ2 NAP 0.00003221 0.41126 2.16216
72 1X87 NAD 0.00003372 0.53338 2.17786
73 5BVA FAD 0.00000004129 0.40072 2.20049
74 1KEW NAD 0.0001157 0.54359 2.21607
75 1KEW TYD 0.0004416 0.51234 2.21607
76 1SC6 NAD 0.000006661 0.58316 2.22772
77 4D3F NAP 0.00001249 0.45478 2.25806
78 1YKJ FAD 0.0000007556 0.66871 2.28426
79 1X7D NAD 0.00003014 0.54552 2.28571
80 1X7D ORN 0.00005474 0.54515 2.28571
81 4CNK FAD 0.00000000671 0.7443 2.30179
82 1ZH8 NAP 0.0002232 0.5012 2.35294
83 1KNR FAD 0.000003333 0.61093 2.40741
84 2BRY FAD 0.000000002605 0.75449 2.41449
85 1GR0 NAD 0.00001526 0.56856 2.45232
86 3ABI NAD 0.000006057 0.41803 2.46575
87 1EBF NAD 0.00001605 0.55103 2.51397
88 2HK9 NAP 0.00005045 0.53093 2.54545
89 2HK9 ATR 0.00003278 0.50428 2.54545
90 4C4A SAH 0.001336 0.45101 2.55102
91 5X20 NAD 0.00005689 0.41608 2.5641
92 4PIV NDP 0.002735 0.45219 2.57576
93 1EK6 UPG 0.001186 0.49426 2.58621
94 2EUG URA 0.01007 0.40426 2.62009
95 3WBF NAP 0.00003483 0.40685 2.62295
96 1VQW FAD 0.00000003493 0.46007 2.62582
97 3QJ4 FAD 0.0000006804 0.40898 2.63158
98 2GVC FAD 0.00000004356 0.69361 2.68456
99 2GV8 FAD 0.00000004731 0.45121 2.68456
100 2GV8 NDP 0.0000184 0.4453 2.68456
101 4BVA NDP 0.0001093 0.52133 2.68657
102 4BVA T3 0.0003852 0.50366 2.68657
103 3DUW SAH 0.002927 0.43489 2.69058
104 2AE2 NAP 0.001343 0.47844 2.69231
105 5TUK FAD 0.0000007648 0.45884 2.69608
106 3LZW FAD 0.000000002304 0.45219 2.71084
107 3HVJ 705 0.0003042 0.5076 2.71493
108 1BXK NAD 0.00003373 0.54312 2.72109
109 5G3U FDA 0.00000008666 0.42151 2.72109
110 1I0Z NAI 0.000009265 0.41362 2.72109
111 3OJF IMJ 0.03386 0.40767 2.72374
112 3OJF NDP 0.03206 0.40331 2.72374
113 3H8V ATP 0.00000313 0.50973 2.73973
114 4AT0 FAD 0.0000182 0.58211 2.7451
115 5DN9 NAD 0.000004487 0.40699 2.74725
116 3O03 NAP 0.004481 0.43607 2.74914
117 3B1F NAD 0.00000132 0.48937 2.75862
118 3VSE SAH 0.009709 0.40008 2.76382
119 4USR FAD 0.00000008898 0.67816 2.77008
120 4J1Q NDP 0.002517 0.44978 2.80172
121 1YS4 NAP 0.001571 0.45149 2.82486
122 1ELI PYC 0.00002184 0.56668 2.82776
123 4Y2H 49K 0.01312 0.42701 2.84091
124 4Y2H SAH 0.01597 0.42265 2.84091
125 5DX0 SFG 0.009398 0.41893 2.86533
126 5DWQ SFG 0.009397 0.41745 2.86533
127 5L95 AMP 0.00001075 0.48142 2.86738
128 2YG3 FAD 0.0000001251 0.40992 2.86976
129 4EUE NAI 0.00004814 0.54055 2.87081
130 5E9W SAH 0.01157 0.4009 2.88462
131 1PGP 6PG 0.003404 0.45357 2.89116
132 1WMA AB3 0.04707 0.40186 2.89116
133 2Q0L NAP 0.00000088 0.55528 2.89389
134 2Q0L FAD 0.0000001559 0.40565 2.89389
135 1VJT NAD 0.002608 0.43726 2.89855
136 1RSG FAD 0.0000003432 0.66423 2.90698
137 1UXG NAD 0.0000004195 0.65348 2.91262
138 1UXG FUM 0.003857 0.48186 2.91262
139 3FWN ATR 0.001074 0.47629 2.91667
140 1YY5 FAD 0.0000005925 0.65499 2.92398
141 1P0F NAP 0.00001858 0.56106 2.94906
142 4MP8 NAD 0.000005881 0.594 2.94985
143 5T9E NAP 0.001686 0.45675 2.95203
144 3FUU ADN 0.0004586 0.41926 2.95203
145 1R6D NAD 0.000208 0.53218 2.96736
146 1R6D DAU 0.0001997 0.53218 2.96736
147 1N4W FAD 0.000003376 0.61483 2.97619
148 5JE8 NAD 0.000003588 0.45464 2.98013
149 5D4V SAH 0.0001411 0.42465 2.98507
150 5BW4 SAM 0.001468 0.41624 2.99625
151 2QA1 FAD 0.00000004824 0.44558 3
152 4POO SAM 0.009795 0.41658 3
153 1DXY NAD 0.0000007633 0.61949 3.003
154 4KOA NDP 0.0004543 0.43306 3.003
155 2BZG SAH 0.01442 0.40026 3.01724
156 2PV7 NAD 0.000002094 0.44508 3.02013
157 1DJN ADP 0.0000000119 0.69911 3.06122
158 2AQJ TRP 0.0000008767 0.66104 3.06122
159 2AQJ FAD 0.0000009192 0.66104 3.06122
160 1ZGA SAH 0.0104 0.40093 3.08123
161 1E7S NAP 0.0006867 0.48329 3.11526
162 1L3I SAH 0.003049 0.44422 3.125
163 4J7U NAP 0.0255 0.4149 3.125
164 4J7U YTZ 0.0255 0.4149 3.125
165 3L9W AMP 0.000004544 0.5896 3.1477
166 3L9W GSH 0.0000336 0.5432 3.1477
167 2WSB NAD 0.003119 0.4598 3.14961
168 2NXE SAM 0.001043 0.41704 3.14961
169 2DFV NAD 0.000001279 0.61074 3.17003
170 4O1M NAD 0.004282 0.44124 3.1746
171 4HXY NDP 0.0002691 0.50199 3.19635
172 3O26 NDP 0.01987 0.40825 3.21543
173 3MJE NDP 0.002572 0.45216 3.22581
174 1HYH NAD 0.0000001869 0.45144 3.23129
175 3NKS FAD 0.0000001908 0.41905 3.23129
176 5KVA SAM 0.0002012 0.41815 3.23741
177 1X14 NAD 0.00005398 0.47175 3.2419
178 3QVP FAD 0.0000001495 0.68422 3.25901
179 4MO2 FDA 0.000001014 0.40651 3.26087
180 4MO2 FAD 0.0000009493 0.40179 3.26087
181 1CF2 NAP 0.00001817 0.55251 3.2641
182 3L4S 3PG 0.00001329 0.56994 3.27381
183 3L4S NAD 0.0000123 0.56994 3.27381
184 4NTC FAD 0.0000003153 0.66458 3.28358
185 2QRK AMP 0.0002044 0.51757 3.29949
186 1W6U NAP 0.01233 0.41173 3.31126
187 1JNR FAD 0.0000001492 0.71631 3.33333
188 3QWI CUE 0.0003865 0.50709 3.33333
189 3QWI NAP 0.0002275 0.50709 3.33333
190 1V8B NAD 0.000003288 0.60514 3.34029
191 4FZV SAM 0.01496 0.40298 3.34728
192 1O0S NAI 0.00005384 0.43059 3.40136
193 1OMO NAD 0.000005976 0.57172 3.41615
194 1T26 NAI 0.00003965 0.55877 3.41615
195 5EVY FAD 0.00002761 0.43597 3.42466
196 4KQW NAP 0.0004998 0.49288 3.42857
197 4REP FAD 0.0000002186 0.40795 3.43434
198 1WPQ NAD 0.001222 0.45853 3.4384
199 3NJ4 NAD 0.00004226 0.60406 3.44828
200 3NJ4 AFX 0.0002122 0.56466 3.44828
201 5THZ SAH 0.01788 0.4024 3.45679
202 1ORR NAD 0.0002095 0.51033 3.45821
203 3JQ9 NAP 0.001398 0.4652 3.47222
204 4M37 SAH 0.001667 0.44646 3.49854
205 3TKY SAH 0.01421 0.40234 3.53261
206 1J5P NAD 0.00001365 0.42485 3.55731
207 1RM4 NDP 0.00000682 0.57523 3.56083
208 5IN4 NAP 0.04298 0.44401 3.57143
209 5IN4 6CK 0.04254 0.44401 3.57143
210 5IN4 GDP 0.04269 0.44339 3.57143
211 2IZ1 ATR 0.0003504 0.49196 3.5865
212 5H81 NAP 0.000214 0.41799 3.59897
213 3NUG NAD 0.005919 0.43558 3.64372
214 1H6C NDP 0.0006161 0.49214 3.69515
215 1H6C SIN 0.001217 0.47951 3.69515
216 2Q1S NAI 0.00002416 0.57102 3.71353
217 2BKA NDP 0.007489 0.42794 3.71901
218 5TS5 FAD 0.0000001588 0.40291 3.71901
219 2OUA AES 0.007995 0.43066 3.7234
220 2WD7 NAP 0.0008679 0.47392 3.73134
221 1GPE FAD 0.0000000521 0.4003 3.7415
222 1D1T NAD 0.000006251 0.4083 3.75335
223 3C3Y SAH 0.006273 0.4192 3.79747
224 3H4V DVP 0.0009567 0.48807 3.81944
225 3H4V NAP 0.001389 0.47875 3.81944
226 5EZ7 FAD 0.00000001424 0.43178 3.82653
227 5T67 JHZ 0.00345 0.46239 3.84615
228 5T67 SAH 0.002885 0.46153 3.84615
229 2ZAT NAP 0.02089 0.40717 3.84615
230 1REO FAD 0.000000115 0.68361 3.90947
231 1CER NAD 0.000001702 0.45835 3.92749
232 1I9G SAM 0.0001398 0.49957 3.92857
233 1PL6 572 0.00002232 0.55711 3.93258
234 1PL6 NAD 0.000009573 0.55491 3.93258
235 1NM5 NAD 0.0001349 0.54108 3.94089
236 1NM5 NAP 0.003035 0.46961 3.94089
237 2F1K NAP 0.000000291 0.47295 3.94265
238 3OJO NAD 0.00000001414 0.54121 3.94432
239 5FJN BE2 0.00000003556 0.71933 3.94737
240 5FJN FAD 0.00000002869 0.71933 3.94737
241 4C3Y FAD 0.000002242 0.62114 3.96226
242 4C3Y ANB 0.000009649 0.59518 3.96226
243 4TSK NDP 0.000465 0.48399 4
244 1R37 NAD 0.00006324 0.53773 4.03458
245 3ULK NDP 0.0009738 0.46142 4.07332
246 3PT9 SAH 0.00289 0.43318 4.08163
247 5N53 8NB 0.001388 0.46004 4.10256
248 3WV8 ATP 0.000000425 0.53212 4.12844
249 4XUC 43G 0.001649 0.46698 4.12844
250 4XUC SAM 0.001649 0.46698 4.12844
251 3GGO NAI 0.00002213 0.57043 4.14013
252 3GGO ENO 0.00002213 0.57043 4.14013
253 4GLL NAD 0.0006175 0.48558 4.1543
254 1I36 NAP 0.00002879 0.53668 4.16667
255 1LUA NAP 0.0003554 0.48031 4.18118
256 2HNK SAH 0.00106 0.45776 4.1841
257 1GV0 NAD 0.000003066 0.59615 4.19355
258 4IDC 1XX 0.0007838 0.4818 4.21687
259 4IDC NDP 0.0007838 0.4818 4.21687
260 2RGJ FAD 0.00000006945 0.45453 4.22886
261 1I8T FAD 0.000002567 0.61522 4.2517
262 3SSO SAH 0.0004701 0.41435 4.29594
263 2GNB MAN 0.01506 0.40023 4.36508
264 1O94 ADP 0.0000000166 0.53075 4.375
265 3ETG GTP 0.001241 0.48431 4.39122
266 3ETG GLU 0.001766 0.48356 4.39122
267 1EZ4 NAD 0.0000009106 0.46094 4.40252
268 3GRU AMP 0.0001485 0.50248 4.40678
269 1O5I NAD 0.009054 0.41164 4.41767
270 3GDN HBX 0.000004781 0.61569 4.42177
271 3GDN FAD 0.000003054 0.61569 4.42177
272 4MDB RLT 0.01516 0.40535 4.44444
273 5CAE COA 0.00001605 0.43688 4.47284
274 1HYE NAP 0.006025 0.42521 4.47284
275 1SOW NAD 0.00000863 0.57758 4.57317
276 1ZEM NAD 0.00008384 0.52019 4.58015
277 5EB4 FAD 0.0000007263 0.64458 4.59184
278 1QO8 FAD 0.00000006096 0.7026 4.59364
279 4W6Z 8ID 0.00004658 0.54728 4.61095
280 4USQ FAD 0.00000006522 0.68688 4.70914
281 3CH6 311 0.01725 0.43627 4.7619
282 3CH6 NAP 0.01725 0.43627 4.7619
283 2GMH FAD 0.00000003349 0.41533 4.7619
284 3OZ2 FAD 0.0000002067 0.41189 4.7619
285 2NAD NAD 0.00004364 0.54726 4.83461
286 4QED NAP 0.007826 0.4283 4.83871
287 4BLW SAH 0.02224 0.40202 4.84429
288 5AYV KPL 0.0000004607 0.64629 4.85437
289 5AYV NAP 0.000001528 0.59789 4.85437
290 5TUF FAD 0.0000004232 0.44401 4.88998
291 2NUO BGC 0.007897 0.4219 4.91803
292 5OFW 9TW 0.007628 0.42528 4.93274
293 2EV9 NAP 0.00002795 0.55226 4.94297
294 4RSL FAD 0.0000004709 0.4219 4.94382
295 2G5C NAD 0.00001152 0.56784 4.98221
296 1N7G NDP 0.0114 0.45017 4.98688
297 1N7G GDR 0.0489 0.40884 4.98688
298 1A5Z NAD 0.0000002472 0.51436 5.01567
299 4JK3 NAD 0.000001228 0.60945 5.01931
300 4J4H 1J1 0.000005649 0.60719 5.01931
301 4J4H NAI 0.000005649 0.60719 5.01931
302 3DAG FEG 0.000228 0.49728 5.02793
303 4L8V NAP 0.000006638 0.57964 5.04451
304 2DC1 NAD 0.00004142 0.53695 5.08475
305 2Q2V NAD 0.003972 0.44668 5.09804
306 1DSS NAD 0.0000001405 0.65282 5.1051
307 2BH9 NAP 0.0006191 0.43706 5.11247
308 1NVM NAD 0.000002552 0.42157 5.12821
309 2DT5 NAD 0.000000379 0.45808 5.21327
310 1TPY SAH 0.0009557 0.46181 5.22648
311 5AOA PPI 0.006656 0.44 5.24476
312 4TQG NDP 0.0008826 0.47356 5.26316
313 5N5D SAM 0.003573 0.43079 5.30973
314 1NW5 SAM 0.01415 0.40242 5.32915
315 5BUK FAD 0.00000003751 0.71658 5.33333
316 3EGI ADP 0.004189 0.4314 5.33981
317 1LDN NAD 0.0000003764 0.64306 5.37975
318 1J0X NAD 0.0000007389 0.64865 5.42169
319 1V6A TRE 0.00529 0.42836 5.42169
320 2IVD FAD 0.00000007548 0.43401 5.43933
321 2FK8 SAM 0.0005732 0.41359 5.44218
322 2GZ3 NAP 0.002678 0.47075 5.46448
323 2VAP GDP 0.01966 0.40725 5.49451
324 1XTP SAI 0.004089 0.42609 5.51181
325 4RDH AMP 0.000004731 0.52504 5.55556
326 4RDI ATP 0.000008542 0.49258 5.55556
327 1KPH SAH 0.001143 0.4581 5.57491
328 1KPG SAH 0.0009403 0.40207 5.57491
329 1YJQ NAP 0.000004824 0.40585 5.61056
330 1LTH NAD 0.0000006393 0.48481 5.64263
331 4TM3 FAD 0.0000005751 0.68003 5.64334
332 1VI2 NAD 0.0005031 0.40663 5.66667
333 4D42 W0I 0.01142 0.43876 5.67376
334 4D42 NAP 0.01142 0.43876 5.67376
335 1DL5 SAH 0.001605 0.45779 5.67823
336 2DBZ NAP 0.00001785 0.55668 5.68862
337 3IHG FAD 0.0000003625 0.63969 5.78231
338 4D79 ATP 0.000001576 0.52156 5.7971
339 3VPH NAD 0.0000009855 0.42153 5.80645
340 3VPH OXM 0.0000004314 0.41869 5.80645
341 3OID NDP 0.0007116 0.48389 5.81395
342 4YSX FAD 0.00000003231 0.4194 5.85106
343 1WDK NAD 0.000001157 0.60368 5.89744
344 1NPD NAD 0.0002379 0.40215 5.90278
345 3H2B SAH 0.002511 0.43804 5.91133
346 2VHW NAI 0.0000007099 0.63861 5.95238
347 1WG8 SAM 0.007716 0.4216 5.96491
348 5LOG SAH 0.0008928 0.40774 6.00858
349 4Q9N NAI 0.005065 0.43893 6.04027
350 1Y8Q ATP 0.00000219 0.46632 6.06936
351 2YY7 NAD 0.0001244 0.51856 6.08974
352 2RGO FAD 0.0000001209 0.67904 6.09555
353 2YYY NAP 0.0002768 0.49828 6.12245
354 3WLE NAD 0.00001492 0.57213 6.15836
355 2FKA BEF 0.00304 0.43495 6.20155
356 3C1O NAP 0.0003777 0.48487 6.23053
357 3DXY SAM 0.00158 0.43626 6.42202
358 3LN9 FLC 0.002384 0.44915 6.47482
359 4J36 1HR 0.00000005966 0.70467 6.50602
360 4J36 FAD 0.00000002996 0.7017 6.50602
361 1F06 NDP 0.0004121 0.49707 6.5625
362 1F06 2NP 0.0004121 0.49707 6.5625
363 1KYQ NAD 0.0000003117 0.56109 6.56934
364 3B9Q MLI 0.02617 0.40085 6.62252
365 1PS9 FAD 0.0000005722 0.65138 6.63265
366 1PS9 NAP 0.0000004559 0.63038 6.63265
367 1LDM NAD 0.000007651 0.41663 6.68693
368 2GDZ NAD 0.004492 0.44021 6.74157
369 3C6K MTA 0.001798 0.46751 6.82415
370 3C6K SPD 0.001798 0.46751 6.82415
371 2VVM FAD 0.000000113 0.68568 6.86869
372 2VVL FAD 0.0000001204 0.40689 6.86869
373 1WP4 NDP 0.00003631 0.41254 6.92042
374 2PWY SAH 0.000498 0.47724 6.97674
375 3AFN NAP 0.01777 0.41414 6.97674
376 1P77 ATR 0.00002721 0.53981 6.98529
377 1PJS NAD 0.00002056 0.53149 7.00219
378 1E6E FAD 0.00000007321 0.6882 7.03125
379 3S5W FAD 0.0000002239 0.65422 7.12743
380 3S5W NAP 0.0000266 0.5235 7.12743
381 4ZNO SUC 0.009748 0.42753 7.16418
382 2DTX BMA 0.002564 0.46308 7.19697
383 1O6Z NAD 0.00003102 0.43259 7.26073
384 1C3V NDP 0.000004241 0.41495 7.34694
385 5I39 FAD 0.00000001803 0.43897 7.35294
386 1Z3C SA8 0.01707 0.41153 7.38255
387 2PT9 2MH 0.001249 0.47301 7.47664
388 2PT9 S4M 0.0008865 0.4687 7.47664
389 3JV7 NAD 0.000008319 0.42022 7.53623
390 2D2I NAP 0.00001187 0.44354 7.63158
391 5GZ6 NDP 0.00002678 0.45593 7.66871
392 5GZ6 7C3 0.00003323 0.43738 7.66871
393 3B20 NAD 0.00001563 0.55158 7.66962
394 3B1J NAD 0.000003546 0.43208 7.66962
395 3QV1 NAD 0.000001583 0.46455 7.71513
396 2XVF FAD 0.0000003411 0.65634 7.75862
397 2XVE FAD 0.000001192 0.65613 7.75862
398 4YCA NDP 0.0000004538 0.46796 7.82313
399 5BSH PRO 0.000207 0.50913 7.94224
400 5TDF 7A3 0.008439 0.40932 8.02469
401 1MV8 NAD 0.00000007973 0.66723 8.02752
402 1HDG NAD 0.00001466 0.43468 8.13253
403 9LDT NAD 0.000001014 0.6218 8.16327
404 9LDB NAD 0.0000009888 0.43533 8.16327
405 3AD8 NAD 0.00000001499 0.71877 8.16832
406 3AD8 FAD 0.0000009835 0.66562 8.16832
407 1MUU NAD 0.0000001649 0.49059 8.25688
408 2VOH CIT 0.002197 0.45206 8.28025
409 2VT3 ATP 0.0000005366 0.5951 8.37209
410 2E5V FAD 0.0000001458 0.68478 8.47458
411 2PZM UDP 0.0001922 0.52485 8.48485
412 2PZM NAD 0.0001922 0.52485 8.48485
413 1Q0S SAH 0.00993 0.41629 8.88031
414 1RYI FAD 0.00000001101 0.73887 8.90052
415 5LD5 NAD 0.00001152 0.45297 8.93855
416 2HMT NAI 0.0000002361 0.51381 9.02778
417 4JNA FAD 0.0000002404 0.40076 9.11765
418 1HKU NAD 0.0000004702 0.44068 9.21788
419 2NVK FAD 0.0000001285 0.68446 9.22131
420 2NVK NAP 0.00000006561 0.59033 9.22131
421 4II2 ATP 0.00001508 0.46736 9.63855
422 3GFB NAD 0.000001673 0.44618 9.71429
423 2NU8 COA 0.000009133 0.43025 9.72222
424 1JG3 ADN 0.0003766 0.42981 9.78723
425 2DPM SAM 0.01164 0.40983 9.85915
426 4B4U NAP 0.01222 0.42114 9.90099
427 1GUZ NAD 0.000002735 0.59664 10
428 3Q9N COA 0.00335 0.44223 10.1266
429 3EGV SAH 0.0005874 0.43163 10.2041
430 5XDT GDP 0.02196 0.40229 10.3896
431 1L1E SAH 0.0006372 0.41353 10.453
432 1LSS NAD 0.0000008359 0.506 10.7143
433 3SJ7 NDP 0.0003949 0.4907 10.7143
434 5ODQ FAD 0.000000003887 0.42981 10.7143
435 1SAY PYR 0.000001477 0.61921 10.8033
436 5O4J 9KH 0.0002439 0.50844 10.9489
437 5O4J SAH 0.0002439 0.50844 10.9489
438 5O4J PJL 0.0002481 0.50667 10.9489
439 1TDF NAP 0.000001472 0.65998 11.0759
440 1TDF FAD 0.0000005366 0.65998 11.0759
441 1PNO NAP 0.009527 0.42408 11.1111
442 3BAZ NAP 0.00003163 0.42284 11.1111
443 5UKL SIX 0.0202 0.40408 11.2903
444 2OOR NAD 0.0004552 0.40538 11.4943
445 5E72 SAM 0.01303 0.40748 11.5607
446 3G5S FAD 0.000000009458 0.44603 11.7381
447 1P1C SAH 0.0000586 0.43244 12.0603
448 4RQU NAD 0.000004312 0.42823 12.2667
449 1AE1 NAP 0.0009433 0.47779 12.4542
450 1ZK4 NAP 0.00689 0.43814 12.749
451 3SQP FAD 0.0000007476 0.7199 14.0167
452 5HSA FAS 0.0000001386 0.40338 14.6259
453 1VM6 NAD 0.0003059 0.49109 15.3509
454 1I1N SAH 0.002667 0.44855 16.8142
455 1NV8 SAM 0.00381 0.44238 17.2535
456 1NV8 MEQ 0.003565 0.44238 17.2535
457 2Y6Q FAD 0.000000009378 0.47726 17.3367
458 2O4C NAD 0.0000006984 0.6298 17.3684
459 2HQM FAD 0.00000004001 0.41312 18.3716
460 4UP3 FAD 0.0000007775 0.64308 18.7898
461 4UP3 NDP 0.00000326 0.57967 18.7898
462 1LVL NAD 0.0000000001816 0.63298 19.4323
463 4G74 FAD 0.000003118 0.40717 19.9203
464 5JCA FAD 0.0000000728 0.40653 21.519
465 3RYC GTP 0.03064 0.40002 21.6783
466 3RNM FAD 0.00000004342 0.40475 22.2222
467 1FL2 FAD 0.0000006144 0.64671 22.5806
468 4EMI FAD 0.0000002102 0.41631 23.1707
469 4EMJ FAD 0.0000003546 0.40802 23.1707
470 2F5Z FAD 0.00000004344 0.71173 23.2068
471 1ZMD NAI 0.0000000002858 0.5756 23.2068
472 1ZMD FAD 0.00000002315 0.40789 23.2068
473 5JWC FAD 0.0000007059 0.42334 23.4165
474 1V59 FAD 0.00000001392 0.74031 24.0586
475 1V59 NAD 0.000000002246 0.70399 24.0586
476 3F8D FAD 0.000006037 0.62703 24.1486
477 1FEC FAD 0.0000003176 0.67174 24.2857
478 2YVF FAD 0.0000000007563 0.82544 25.2451
479 2YVF NAD 0.0000000008019 0.82544 25.2451
480 2YVJ NAI 0.0000000002566 0.66154 25.2451
481 2YVJ FAD 0.0000004386 0.40922 25.2451
482 4M52 FAD 0.00000002232 0.41296 25.7511
483 5JCM NAD 0.0000006232 0.6752 26.1641
484 5JCM ISD 0.000001497 0.65491 26.1641
485 5JCM FAD 0.000001435 0.65491 26.1641
486 1Q1R FAD 0.000001649 0.40233 26.2181
487 3FG2 FAD 0.0000003467 0.4374 26.7327
488 1MO9 FAD 0.000000102 0.72896 26.9598
489 1MO9 KPC 0.0000001453 0.7215 26.9598
490 1GET NAP 0.000000152 0.711 27.7778
491 1GET FAD 0.0000001391 0.711 27.7778
492 3QFA FAD 0.0000002383 0.40009 27.9383
493 3LAD FAD 0.00000002375 0.72353 27.9412
494 3AB1 FAD 0.000000002878 0.44005 28.3333
495 1BZL FAD 0.000001394 0.67708 28.3951
496 4JDR FAD 0.00000001001 0.42413 29.1139
497 3KLJ FAD 0.00000002831 0.46584 29.3506
498 5KMS FAD 0.000001475 0.40826 29.3827
499 2WPF WPF 0.0000008212 0.69119 29.4949
500 2WPF FAD 0.000001123 0.68157 29.4949
501 2Q7V FAD 0.000000004346 0.43301 32.3077
502 2CDU ADP 0.0000000003012 0.75735 46.2389
503 2CDU FAD 0.000000155 0.67182 46.2389
504 2NPX FAD 0.000003685 0.4011 49.217
Pocket No.: 2; Query (leader) PDB : 3ICS; Ligand: COA; Similar sites found: 22
This union binding pocket(no: 2) in the query (biounit: 3ics.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4WOE 3S5 0.01439 0.42882 1.02041
2 1J78 VDY 0.03836 0.40215 2.18341
3 5FQK 6NT 0.0286 0.41408 2.60223
4 4Q86 AMP 0.01655 0.40977 2.90102
5 5V4R MGT 0.02075 0.41887 3.7037
6 4RW3 PLM 0.01709 0.40546 3.97351
7 5CKS GAL 0.03365 0.413 3.9886
8 4I90 CHT 0.0366 0.40974 4.62046
9 5CHR 4NC 0.005971 0.45245 5.10949
10 4UCC ZKW 0.00816 0.44123 5.15021
11 2X2T GAL NGA 0.02096 0.4352 5.22876
12 3A8H TAY 0.01378 0.43576 5.31401
13 5UGW GSH 0.004622 0.43024 5.71429
14 5U75 SIA GAL NDG FUC 0.02361 0.4142 5.78231
15 2VWA PTY 0.004812 0.46138 5.94059
16 3RLF MAL 0.03984 0.40128 6.42023
17 3KP6 SAL 0.04061 0.4029 7.94702
18 4LHM AZZ 0.03461 0.40885 9.09091
19 4TV1 36M 0.04006 0.40501 9.96016
20 5MWE TCE 0.008952 0.43998 11.1111
21 5C2N NAG 0.04972 0.40061 18.75
22 1SQL GUN 0.02151 0.42011 23.9726
Pocket No.: 3; Query (leader) PDB : 3ICS; Ligand: FAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3ics.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3ICS; Ligand: FAD; Similar sites found: 522
This union binding pocket(no: 4) in the query (biounit: 3ics.bio1) has 39 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2DKH FAD 0.000000008814 0.5611 1.02041
2 2DKH 3HB 0.00000007497 0.55452 1.02041
3 3CMC NAD 0.00318 0.41393 1.1976
4 1H82 GZZ 0.0000002122 0.56568 1.27119
5 1H82 FAD 0.0000001476 0.46795 1.27119
6 2ZXI FAD 0.000000008552 0.59012 1.36054
7 4EIP K2C 0.00000003689 0.57656 1.45719
8 4EIP FAD 0.00000003689 0.51652 1.45719
9 5UAO FAD 0.000001176 0.51153 1.47874
10 3PDB OAA 0.04757 0.40506 1.49626
11 5WGR FAD 0.0000003015 0.52065 1.53061
12 1LJ8 NAD 0.00237 0.43623 1.62272
13 1M2W NAD 0.002795 0.42988 1.62272
14 1H2B NAJ 0.001632 0.41447 1.67131
15 5EOW FAD 0.000000003947 0.61763 1.70068
16 4MIG G3F 0.0000005037 0.53884 1.70068
17 3CBG SAH 0.0006148 0.47858 1.72414
18 2B4R NAD 0.0001495 0.4593 1.73913
19 2B4R AES 0.0004264 0.44484 1.73913
20 3UCL NAP 0.00000377 0.52508 1.7452
21 3UCL FAD 0.000003528 0.52341 1.7452
22 3UCL CYH 0.000003528 0.52341 1.7452
23 3E1T FAD 0.0000000007116 0.5856 1.75781
24 3KB6 NAD 0.007702 0.40049 1.79641
25 5KVS NAP 0.003317 0.42365 1.81818
26 1F8G NAD 0.003882 0.42681 1.82292
27 3DMH SAM 0.001942 0.4435 1.83727
28 3DMH GMP 0.003995 0.412 1.83727
29 2EJU SAH 0.0009395 0.46557 1.85185
30 5F8F SFG 0.002242 0.45604 1.85676
31 1H5Q NAP 0.002212 0.41443 1.88679
32 3OA2 NAD 0.005835 0.40291 1.88679
33 1G60 SAM 0.01323 0.40903 1.92308
34 2IYF UDP 0.03188 0.41357 1.92771
35 3CIF NAD 0.0001026 0.41683 1.94986
36 4DPL NAP 0.005957 0.4002 1.94986
37 2Q28 ADP 0.008196 0.41855 1.95035
38 1BW9 NAD 0.0002951 0.47596 1.96629
39 1C1X NAD 0.0002218 0.46605 1.97183
40 3G89 SAM 0.000323 0.50201 2.00803
41 2P4Q FLC 0.03985 0.4189 2.01207
42 3H9E NAD 0.0001889 0.4689 2.02312
43 4JJF FE9 0.004545 0.40974 2.03488
44 4TXI FAD 0.00000001902 0.60313 2.04082
45 4MOP 2H5 0.0000003077 0.4706 2.04082
46 4XFR CIT 0.01967 0.42746 2.04082
47 1Z45 NAD 0.002464 0.41515 2.04082
48 3D3W NAP 0.003053 0.40435 2.04918
49 3V1Y NAD 0.0001318 0.4753 2.07715
50 3HIY UTP 0.02568 0.40774 2.08333
51 2RGH FAD 0.000003705 0.49729 2.10158
52 1ZQ9 SAM 0.0001403 0.50396 2.10526
53 1RP0 AHZ 0.0000001209 0.51775 2.11268
54 2VYN NAD 0.0001747 0.46327 2.1148
55 1F8F NAD 0.005757 0.41076 2.15633
56 1GQ2 NAP 0.0008645 0.43578 2.16216
57 5MPT SAH 0.01602 0.40817 2.17391
58 2C7G ODP 0.0000003074 0.4614 2.19298
59 2C7G FAD 0.0000003316 0.45696 2.19298
60 5BVA FAD 0.000000001505 0.56926 2.20049
61 3S1S SAH 0.006365 0.41444 2.21088
62 5W0N 2KH 0.03183 0.40306 2.21088
63 5X62 SAH 0.00769 0.42648 2.21675
64 5THY SAH 0.005087 0.42477 2.22222
65 1SC6 NAD 0.0005727 0.40155 2.22772
66 4RPL FAD 0.000002188 0.41891 2.25564
67 4RPL 3UC 0.00000342 0.40836 2.25564
68 1C3X 8IG 0.03866 0.40136 2.25564
69 4D3F NAP 0.002578 0.43462 2.25806
70 3VYW SAM 0.0007818 0.46118 2.27273
71 1YKJ FAD 0.0000003179 0.56026 2.28426
72 1YKJ PHB 0.0000003179 0.43966 2.28426
73 1MAI I3P 0.01103 0.43534 2.29008
74 3LST SAH 0.02003 0.41314 2.29885
75 4CNK FAD 0.000000002733 0.60241 2.30179
76 3BGD SAH 0.01078 0.41309 2.30769
77 1LLU NAD 0.001725 0.41119 2.33918
78 3FPF MTA 0.0006621 0.41295 2.34899
79 3FPF TNA 0.0006621 0.41295 2.34899
80 1KNR FAD 0.0000000149 0.58064 2.40741
81 2BRY FAD 0.0000000306 0.54312 2.41449
82 1D4D FAD 0.000000009465 0.55117 2.44755
83 2JB2 FAD 0.0000003324 0.52473 2.45399
84 2JB2 PHE 0.0000003696 0.51768 2.45399
85 3ABI NAD 0.001613 0.42233 2.46575
86 5UAV TFB 0.001773 0.40619 2.48447
87 5UAV NDP 0.001773 0.40619 2.48447
88 3AYI FAD 0.00000004366 0.49659 2.55102
89 3AYI HCI 0.00000004752 0.4916 2.55102
90 5HJM MTA 0.009499 0.41562 2.55682
91 5X20 NAD 0.005839 0.41051 2.5641
92 3WE0 FAD 0.0000003642 0.50249 2.58621
93 3WBF NAP 0.0007721 0.43772 2.62295
94 3WBF API 0.001771 0.41315 2.62295
95 1VQW FAD 0.0000001266 0.56722 2.62582
96 3QJ4 FAD 0.0000001008 0.54834 2.63158
97 2V57 PRL 0.02688 0.42198 2.63158
98 1VE3 SAM 0.01459 0.41007 2.64317
99 3G2O SAM 0.002057 0.44975 2.67559
100 2YX1 SFG 0.0006405 0.4873 2.67857
101 2GV8 FAD 0.0000001948 0.55566 2.68456
102 2GVC FAD 0.0000001543 0.52014 2.68456
103 2GV8 NDP 0.0004374 0.46094 2.68456
104 5TUK FAD 0.0000004276 0.57178 2.69608
105 3LZW FAD 0.000000004044 0.59654 2.71084
106 3LZW NAP 0.0000000186 0.47961 2.71084
107 3HVJ 705 0.0007688 0.41151 2.71493
108 5G3U FDA 0.0000002426 0.53518 2.72109
109 5G3U ITW 0.000002494 0.47244 2.72109
110 1GTE FAD 0.0000001276 0.45561 2.72109
111 1I0Z NAI 0.0006569 0.43753 2.72109
112 4U8P FDA 0.000002911 0.40716 2.72904
113 4U8P UDP 0.000003251 0.40146 2.72904
114 1P31 EPU 0.02319 0.40063 2.73684
115 3H8V ATP 0.00009223 0.51243 2.73973
116 4AT0 FAD 0.000006138 0.49875 2.7451
117 5DN9 NAD 0.003653 0.40145 2.74725
118 3B1F NAD 0.00008969 0.49867 2.75862
119 4USR FAD 0.000000469 0.50504 2.77008
120 1H8S AIC 0.03799 0.40946 2.77778
121 1ELI PYC 0.00001063 0.47854 2.82776
122 5DX8 SFG 0.009133 0.40765 2.86533
123 5DXA