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Receptor
PDB id Resolution Class Description Source Keywords
3CGB 1.9 Å EC: 1.-.-.- PYRIDINE NUCLEOTIDE COMPLEXES WITH BACILLUS ANTHRACIS COENZY DISULFIDE REDUCTASE: A STRUCTURAL ANALYSIS OF DUAL NAD(P)H S PECIFICITY BACILLUS ANTHRACIS STR. COENZYME A FLAVIN ADENINE DINUCLEOTIDE SELENOMETHIONINE FFLAVOPROTEIN OXIDOREDUCTASE
Ref.: PYRIDINE NUCLEOTIDE COMPLEXES WITH BACILLUS ANTHRAC COENZYME A-DISULFIDE REDUCTASE: A STRUCTURAL ANALYS DUAL NAD(P)H SPECIFICITY. BIOCHEMISTRY V. 47 5182 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
COA A:445;
B:445;
Invalid;
Invalid;
none;
none;
submit data
767.534 C21 H36 N7 O16 P3 S CC(C)...
FAD A:446;
B:446;
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
3CGB 1.9 Å EC: 1.-.-.- PYRIDINE NUCLEOTIDE COMPLEXES WITH BACILLUS ANTHRACIS COENZY DISULFIDE REDUCTASE: A STRUCTURAL ANALYSIS OF DUAL NAD(P)H S PECIFICITY BACILLUS ANTHRACIS STR. COENZYME A FLAVIN ADENINE DINUCLEOTIDE SELENOMETHIONINE FFLAVOPROTEIN OXIDOREDUCTASE
Ref.: PYRIDINE NUCLEOTIDE COMPLEXES WITH BACILLUS ANTHRAC COENZYME A-DISULFIDE REDUCTASE: A STRUCTURAL ANALYS DUAL NAD(P)H SPECIFICITY. BIOCHEMISTRY V. 47 5182 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 318 families.
1 3CGB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 280 families.
1 3CGB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 187 families.
1 3CGB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FAD; Similar ligands found: 128
No: Ligand ECFP6 Tc MDL keys Tc
1 FAD 1 1
2 FAS 1 1
3 FAY 0.859259 0.9875
4 RFL 0.852941 0.963855
5 6FA 0.794118 0.987654
6 FAE 0.751773 0.987654
7 SFD 0.651007 0.860215
8 FDA 0.641892 0.906977
9 FNK 0.602564 0.876405
10 62F 0.572327 0.939024
11 F2N 0.566265 0.886364
12 FMN 0.543307 0.876543
13 FA9 0.526316 0.939759
14 6YU 0.516304 0.860215
15 P6G FDA 0.511628 0.908046
16 FAD NBT 0.508876 0.83871
17 A2D 0.504065 0.875
18 P5F 0.491329 0.941176
19 FAD CNX 0.488506 0.8125
20 AR6 0.488372 0.851852
21 APR 0.488372 0.851852
22 AGS 0.484615 0.811765
23 SAP 0.484615 0.811765
24 M33 0.484375 0.864198
25 BA3 0.484127 0.875
26 HEJ 0.48062 0.851852
27 ATP 0.48062 0.851852
28 ADP 0.480315 0.851852
29 B4P 0.480315 0.875
30 AP5 0.480315 0.875
31 ANP 0.477273 0.831325
32 AQP 0.476923 0.851852
33 5FA 0.476923 0.851852
34 48N 0.469388 0.902439
35 OAD 0.467626 0.876543
36 9X8 0.467626 0.833333
37 FAD NBA 0.467033 0.793814
38 GTA 0.465753 0.892857
39 AN2 0.465116 0.841463
40 AT4 0.465116 0.821429
41 AD9 0.462121 0.831325
42 3OD 0.460993 0.876543
43 RBF 0.460938 0.790123
44 FB0 0.460606 0.835165
45 139 0.460526 0.858824
46 AP0 0.46 0.835294
47 A22 0.459854 0.864198
48 ACP 0.458015 0.853659
49 8QN 0.456522 0.864198
50 PRX 0.454545 0.831325
51 A3R 0.453237 0.86747
52 A1R 0.453237 0.86747
53 G3A 0.452055 0.902439
54 T5A 0.45098 0.872093
55 G5P 0.44898 0.902439
56 ATF 0.448529 0.821429
57 50T 0.44697 0.819277
58 6YZ 0.445255 0.853659
59 ACQ 0.444444 0.853659
60 CNV FAD 0.443182 0.917647
61 ADQ 0.442857 0.853659
62 PAJ 0.442857 0.847059
63 5AL 0.441176 0.864198
64 ADX 0.439394 0.775281
65 CA0 0.439394 0.853659
66 A4P 0.437909 0.831461
67 25L 0.4375 0.864198
68 P33 FDA 0.436464 0.817204
69 5SV 0.435714 0.793103
70 OMR 0.434211 0.818182
71 TXE 0.434211 0.890244
72 ABM 0.434109 0.829268
73 A 0.433071 0.82716
74 AMP 0.433071 0.82716
75 4AD 0.432624 0.855422
76 ADJ 0.432258 0.818182
77 B5M 0.431507 0.878049
78 B5Y 0.431507 0.878049
79 BIS 0.430556 0.802326
80 SRA 0.429688 0.788235
81 AFH 0.42953 0.825581
82 NXX 0.427632 0.865854
83 DND 0.427632 0.865854
84 UP5 0.427632 0.878049
85 6V0 0.427632 0.857143
86 TXD 0.427632 0.890244
87 DQV 0.426667 0.8875
88 SRP 0.42446 0.843373
89 PR8 0.423611 0.837209
90 T99 0.423358 0.821429
91 TAT 0.423358 0.821429
92 AMO 0.422535 0.865854
93 TXA 0.42069 0.865854
94 FYA 0.42069 0.864198
95 PTJ 0.42069 0.835294
96 CNA 0.420382 0.865854
97 00A 0.41958 0.823529
98 AHX 0.41958 0.835294
99 MAP 0.41844 0.811765
100 NAI 0.418301 0.845238
101 AU1 0.41791 0.831325
102 A12 0.416667 0.843373
103 AP2 0.416667 0.843373
104 25A 0.415493 0.851852
105 9ZA 0.415493 0.845238
106 9ZD 0.415493 0.845238
107 COD 0.415094 0.842697
108 4TC 0.412903 0.879518
109 APC 0.411765 0.843373
110 ME8 0.410959 0.806818
111 1ZZ 0.410959 0.806818
112 NB8 0.410959 0.835294
113 4UW 0.409091 0.825581
114 NAX 0.409091 0.837209
115 F2R 0.408805 0.850575
116 RBY 0.408759 0.843373
117 ADV 0.408759 0.843373
118 P1H 0.405882 0.818182
119 OOB 0.405594 0.864198
120 LAD 0.40411 0.825581
121 A A 0.40411 0.829268
122 UPA 0.403846 0.86747
123 4UU 0.401316 0.833333
124 GA7 0.401316 0.865854
125 A3D 0.401235 0.876543
126 80F 0.401235 0.808989
127 XAH 0.4 0.806818
128 DLL 0.4 0.864198
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3CGB; Ligand: FAD; Similar sites found with APoc: 900
This union binding pocket(no: 1) in the query (biounit: 3cgb.bio1) has 38 residues
No: Leader PDB Ligand Sequence Similarity
1 2PZM UDP 0.909091
2 2PZM NAD 0.909091
3 4AZW SAM 1.06157
4 1PJS NAD 1.09409
5 3FUU ADN 1.10701
6 3BGD SAH 1.15385
7 4J36 1HR 1.20482
8 4J36 FAD 1.20482
9 1CDO NAD 1.3369
10 1GR0 NAD 1.3624
11 2JJQ SAH 1.41176
12 2DKH FAD 1.45833
13 2DKH 3HB 1.45833
14 4ARE FLC 1.45833
15 3PT9 SAH 1.45833
16 1AMU AMP 1.45833
17 4R5M NAP 1.45833
18 1QMG APX 1.45833
19 1LLU NAD 1.46199
20 5TUK FAD 1.47059
21 5THY SAH 1.48148
22 5THZ SAH 1.48148
23 1DLJ NAI 1.49254
24 1DLJ UGA 1.49254
25 4KOA NDP 1.5015
26 2GLX NDP 1.50602
27 4J1Q NDP 1.50862
28 3DMH SAM 1.5748
29 3DMH GMP 1.5748
30 5TC4 NAD 1.58228
31 1O5I NAD 1.60643
32 3GWZ SAH 1.62602
33 1UWK URO 1.66667
34 1UWK NAD 1.66667
35 1LJ8 NAD 1.66667
36 2P4Q FLC 1.66667
37 1M2W NAD 1.66667
38 4PIV NDP 1.66667
39 4XQC 13D 1.68421
40 4XQC NAD 1.68421
41 5ZI2 NAD 1.73913
42 5ZI2 ADP 1.73913
43 1VQW FAD 1.75055
44 2YG3 FAD 1.766
45 1YKJ FAD 1.77665
46 1YKJ PHB 1.77665
47 1OKE BOG 1.77665
48 2GV8 FAD 1.78971
49 2GVC FAD 1.78971
50 2GV8 NDP 1.78971
51 3G5S FAD 1.80587
52 5KVS NAP 1.81818
53 1L7E NAI 1.82292
54 1SOW NAD 1.82927
55 6BWL NAD 1.82927
56 1MUU NAD 1.83486
57 1MV8 NAD 1.83486
58 3OFK SAH 1.85185
59 1E3I CXF 1.8617
60 4DCM SAM 1.86667
61 4XFR CIT 1.87354
62 4AP3 FAD 1.875
63 4AP3 NAP 1.875
64 5UAO FAD 1.875
65 4MIG G3F 1.875
66 1Z45 NAD 1.875
67 1VJT NAD 1.875
68 2IXB NAD 1.875
69 3LU1 NAD 1.92308
70 5W7K SAH 1.92308
71 1DMH MCT 1.92926
72 3V1U NAD 1.94805
73 5HSA FAS 1.96078
74 5JY6 NAD 1.96629
75 2P41 SAH 1.96721
76 5X62 SAH 1.97044
77 5DWQ SFG 2.00573
78 5DX1 SFG 2.00573
79 5DX8 SFG 2.00573
80 5DXA SFG 2.00573
81 5DX0 SFG 2.00573
82 2VTD LKM 2.02247
83 1JQ3 AAT 2.02703
84 4DMG SAM 2.03562
85 5X68 FAD 2.04604
86 3HIY UTP 2.08333
87 1X87 NAD 2.08333
88 1LUA NAP 2.09059
89 1KPH SAH 2.09059
90 1KPG SAH 2.09059
91 6EL3 NAP 2.09974
92 3QOX SAH 2.11268
93 2EJU SAH 2.1164
94 5VE5 GSH 2.12202
95 3CBG SAH 2.15517
96 5MPT SAH 2.17391
97 3EVG SAH 2.18182
98 5O4J 9KH 2.18978
99 5O4J SAH 2.18978
100 5O4J PJL 2.18978
101 1KYZ SAH 2.19178
102 2C7G FAD 2.19298
103 2C7G ODP 2.19298
104 1NW5 SAM 2.19436
105 3ACC 5GP 2.20994
106 1EBF NAD 2.23464
107 3T7S SAM 2.23881
108 3O9Z NAD 2.24359
109 3O9Z AKG 2.24359
110 3HO6 IHP 2.24719
111 1C3X 8IG 2.25564
112 1YS4 NAP 2.25989
113 1UXG NAD 2.26537
114 1UXG FUM 2.26537
115 4NEC SAH 2.27273
116 2EV9 SKM 2.28137
117 2EV9 NAP 2.28137
118 5WP5 SAH 2.29167
119 6D6Y SAH 2.29167
120 5WP4 SAH 2.29167
121 1OBB NAD 2.29167
122 3A1I UNU 2.29167
123 2FR1 NDP 2.29167
124 4XUC SAM 2.29358
125 4XUC 43G 2.29358
126 5EZ7 FAD 2.29592
127 3BY9 SIN 2.30769
128 2ZAT NAP 2.30769
129 6AA8 NAD 2.31788
130 2PWY SAH 2.32558
131 1J5P NAD 2.37154
132 3SJ7 NDP 2.38095
133 3SSO SAH 2.38663
134 3KB6 NAD 2.39521
135 3CMC NAD 2.39521
136 4Z0H NAD 2.39521
137 2CFC NAD 2.4
138 1D1T NAD 2.41287
139 1CER NAD 2.41692
140 3NUG NAD 2.42915
141 3JQA NAP 2.43056
142 4CMI NAP 2.43056
143 3JQ9 NAP 2.43056
144 3BMN NAP 2.43056
145 4CM9 NAP 2.43056
146 3JQ8 NAP 2.43056
147 4CLR NAP 2.43056
148 3JQF NAP 2.43056
149 4CM8 NAP 2.43056
150 3BMO NAP 2.43056
151 3JQ7 NAP 2.43056
152 3BMQ NAP 2.43056
153 4CLO NAP 2.43056
154 4CM4 NAP 2.43056
155 2CVQ NDP 2.44648
156 5EOW FAD 2.46914
157 5K4W NAI 2.49221
158 2BRY FAD 2.5
159 4TXI FAD 2.5
160 3S5W FAD 2.5
161 3S5W NAP 2.5
162 5WGR FAD 2.5
163 1O0S NAI 2.5
164 4U36 TNR 2.5
165 1H2B NAJ 2.50696
166 5EVY FAD 2.51142
167 5LD5 NAD 2.51397
168 1GY8 NAD 2.51889
169 1DRV A3D 2.5641
170 1KEV NDP 2.5641
171 4N49 SAM 2.57009
172 4IX4 ADP 2.57143
173 2NU8 COA 2.57732
174 5UR0 NAD 2.5788
175 3ZNN FAD 2.59366
176 3ZNN 4WL 2.59366
177 3WGT FAD 2.59366
178 3WGT QSC 2.59366
179 1R37 NAD 2.59366
180 3MAG SAH 2.60586
181 2WD7 NAP 2.61194
182 5YU3 NAD 2.61628
183 5YU3 PRO 2.61628
184 4EUE NAI 2.63158
185 1YXM ADE 2.64026
186 4XDY NAI 2.66272
187 1UDB UFG 2.66272
188 1UDB NAD 2.66272
189 2EG5 SAH 2.68817
190 5TUF TDC 2.68949
191 5TUF FAD 2.68949
192 3MCT SAH 2.6936
193 4ZCC NAI 2.70833
194 4ZCC FAD 2.70833
195 3X0V FAD 2.70833
196 1Q0S SAH 2.70833
197 5Y8L NAD 2.71186
198 5Y8L HUI 2.71186
199 6BQ6 TER 2.71903
200 2IZ1 ATR 2.74262
201 2E5V FAD 2.75424
202 3U31 NAD 2.75862
203 5YF1 SFG 2.76243
204 5JGL SAM 2.76817
205 1EJ0 SAM 2.77778
206 5L53 NAP 2.77778
207 5A96 GTP 2.81124
208 4CJX NAP 2.82132
209 1GZ6 NAI 2.82132
210 2I7C AAT 2.82686
211 5O9F 9ON 2.84091
212 1SB8 NAD 2.84091
213 1SB8 UD2 2.84091
214 4MCC 21X 2.84553
215 1YID ATP 2.849
216 2F1K NAP 2.86738
217 1QAN SAH 2.86885
218 6B74 BEN 2.88066
219 1DCP HBI 2.88462
220 4ZRN NAD 2.88462
221 4ZRN UPG 2.88462
222 6FA4 D1W 2.89017
223 2O4C NAD 2.89474
224 1EQ2 NAP 2.90323
225 5BRT FAD 2.91667
226 4MOP 2H5 2.91667
227 5BRT CH9 2.91667
228 4CP8 MLI 2.91667
229 1Y8Q ATP 2.91667
230 2X6T NAP 2.91667
231 1H5Q NAP 2.91667
232 5HJM MTA 2.91667
233 3S1S SAH 2.91667
234 3QJ4 FAD 2.92398
235 5A1T NAI 2.93255
236 3A27 SAM 2.94118
237 1P0F NAP 2.94906
238 1NM5 NAD 2.95567
239 4YUW 4JU 2.96053
240 4YUW S4M 2.96053
241 1F8F NAD 2.96496
242 3V1Y NAD 2.96736
243 1CF2 NAP 2.96736
244 4OOE FOM 2.9703
245 4OOE NDP 2.9703
246 2YX1 SFG 2.97619
247 2RGJ FAD 2.98507
248 5ULP KB1 2.98507
249 4MDH NAD 2.99401
250 4POO SAM 3
251 3BAZ NAP 3.003
252 5MDH NAD 3.003
253 2GZ3 NAP 3.00546
254 1V6A TRE 3.01205
255 4ZVV GN0 3.01205
256 4ZVV NAD 3.01205
257 1KOL NAD 3.01508
258 1PZG A3D 3.02115
259 4YCA NDP 3.06122
260 1WVG APR 3.06407
261 1R18 SAH 3.0837
262 5H81 NAP 3.08483
263 1OMO NAD 3.10559
264 3IHG FAD 3.125
265 4RDH AMP 3.125
266 2JB2 PHE 3.125
267 2JB2 FAD 3.125
268 4RDI ATP 3.125
269 1COY FAD 3.125
270 1COY AND 3.125
271 5YB7 ORN 3.125
272 5YB7 FAD 3.125
273 2D3N GLC GLC GLC 3.125
274 5TE1 7A2 3.125
275 5WKC TP9 3.125
276 3DUW SAH 3.13901
277 5KOX RFP 3.15126
278 5KOX FAD 3.15126
279 1WG8 SAM 3.15789
280 1P19 IMP 3.16742
281 5Y77 FAD 3.17125
282 6F3N ADN 3.17797
283 6F3N NAD 3.17797
284 4HXY NDP 3.19635
285 4TQK NAG 3.20197
286 5E9W SAH 3.20513
287 3NJ4 NAD 3.21839
288 3NJ4 AFX 3.21839
289 1GUZ NAD 3.22581
290 3JWH SAH 3.22581
291 1GV0 NAD 3.22581
292 5MB4 NAG 3.2419
293 2RH4 EMO 3.2491
294 5MZI FAD 3.2538
295 5MZI FYK 3.2538
296 4D79 ATP 3.26087
297 6F3M NAD 3.26087
298 1SQF SAM 3.2634
299 1HGX 5GP 3.27869
300 2CDC NAP 3.27869
301 2CDC XYS 3.27869
302 2CDC XYP 3.27869
303 4BVA NDP 3.28358
304 1JAY NAP 3.30189
305 4BJZ P3A 3.30189
306 4BJZ FAD 3.30189
307 6F9Q NAD 3.30882
308 2DT5 NAD 3.31754
309 1PZM 5GP 3.31754
310 5E1M SAH 3.3195
311 1NYT NAP 3.32103
312 1RYI GOA 3.33333
313 1RYI FAD 3.33333
314 5JJR SAH 3.33333
315 5N9X THR 3.33333
316 4GN8 ASO 3.34448
317 2IVD FAD 3.34728
318 4KIB SAH 3.36134
319 1ZGA SAH 3.36134
320 2YGM GLA NAG GAL FUC 3.38983
321 2R4J FAD 3.39321
322 2R4J 13P 3.39321
323 5ERG SAM 3.39426
324 5Z3I ADE 3.39623
325 3C6K SPD 3.41207
326 3C6K MTA 3.41207
327 5C9P FUC 3.41207
328 5UAV TFB 3.41615
329 5UAV NDP 3.41615
330 2PT9 S4M 3.42679
331 3LKZ SFG 3.42679
332 2PT9 2MH 3.42679
333 2VVM FAD 3.43434
334 2VVL FAD 3.43434
335 1F06 NDP 3.4375
336 2OOR NAD 3.44828
337 1OC2 TDX 3.44828
338 1OC2 NAD 3.44828
339 2OOR TXP 3.44828
340 4IWN GEK 3.49345
341 4M37 SAH 3.49854
342 4M38 SAH 3.49854
343 4DSG FAD 3.5124
344 4DSG UDP 3.5124
345 4EIP FAD 3.54167
346 4REP FAD 3.54167
347 4EIP K2C 3.54167
348 1NAA 6FA 3.54167
349 1NAA ABL 3.54167
350 3GFS FMN 3.54167
351 1VL8 NAP 3.54167
352 5FA5 MTA 3.54223
353 3GCZ SAM 3.5461
354 5M67 NAD 3.54906
355 5M67 ADE 3.54906
356 5M67 3D1 3.54906
357 4GLL NAD 3.56083
358 1ZGS XMM 3.57942
359 1J49 NAD 3.6036
360 5ZYN FAD 3.60934
361 1O9P MLA 3.62319
362 1W8D NAP 3.64238
363 1W73 NAP 3.64238
364 1W6U NAP 3.64238
365 3A25 SAM 3.65448
366 1XA4 COA 3.66133
367 3DXY SAM 3.66972
368 3HB5 NAP 3.66972
369 5GZ6 NDP 3.68098
370 5GZ6 7C3 3.68098
371 3H5N ATP 3.68272
372 2V57 PRL 3.68421
373 2DFV NAD 3.7464
374 5KJW 53C 3.74707
375 1PS9 FAD 3.75
376 3NKS FAD 3.75
377 1YY5 FAD 3.75
378 1RSG FAD 3.75
379 4C3Y FAD 3.75
380 1PS9 NAP 3.75
381 4C3Y ANB 3.75
382 3TLJ SAH 3.75
383 2HNK SAH 3.76569
384 3BXO SAM 3.76569
385 2B4R NAD 3.76812
386 2B4R AES 3.76812
387 1NVM NAD 3.76812
388 4GQB 0XU 3.77907
389 1WP4 NDP 3.80623
390 2CVZ NDP 3.80623
391 1R6D NAD 3.85757
392 1R6D DAU 3.85757
393 5LOG SAH 3.86266
394 1HYH NAD 3.8835
395 1K3T BRZ 3.89972
396 9LDT NAD 3.91566
397 9LDB NAD 3.91566
398 1DIG NAP 3.92157
399 2VYN NAD 3.92749
400 1GAD NAD 3.93939
401 3OJO NAD 3.94432
402 1VM6 NAD 3.94737
403 1LDM NAD 3.95137
404 2ZXI FAD 3.95833
405 4D04 FAD 3.95833
406 4D04 NAP 3.95833
407 5OC1 FAD 3.95833
408 6F97 FAD 3.95833
409 1GQ2 NAP 3.96396
410 3KU0 ADE 3.98406
411 5BUK FAD 4
412 3GFB NAD 4
413 1E5Q NDP 4
414 3Q3C NAD 4.01338
415 5Z20 NAI 4.05797
416 2GN4 NDP 4.06977
417 2GN4 UD1 4.06977
418 3HVJ 705 4.0724
419 1UP7 NAD 4.07674
420 5O96 SAM 4.08163
421 1HDR NAD 4.09836
422 5D4V SAH 4.10448
423 3H8V ATP 4.10959
424 5DN9 NAD 4.12088
425 4USQ FAD 4.15512
426 3AYI FAD 4.16089
427 3AYI HCI 4.16089
428 2AQJ TRP 4.16667
429 2AQJ FAD 4.16667
430 4YNU FAD 4.16667
431 4YNU LGC 4.16667
432 2JHP SAH 4.16667
433 1ZQ9 SAM 4.16667
434 4C4A SAH 4.16667
435 3OND ADN 4.16667
436 3OND NAD 4.16667
437 4YMH SAH 4.16667
438 5X20 NAD 4.16667
439 5D63 FUC GLA GLA 4.16667
440 1GZ4 ATP 4.16667
441 3CIF NAD 4.17827
442 4FZV SAM 4.17827
443 3CIF G3H 4.17827
444 1L1E SAH 4.18118
445 2PXX SAH 4.18605
446 1DSS NAD 4.2042
447 1E3W NAD 4.21456
448 1WQ1 AF3 4.21687
449 3K5I AIR 4.21836
450 3GU3 SAH 4.22535
451 1E6W NAD 4.23077
452 3A06 NDP 4.25532
453 5GZ9 MAN 4.2623
454 1I9G SAM 4.28571
455 1X7D NAD 4.28571
456 6AIN FAD 4.30622
457 5ZZ6 NAD 4.32692
458 5ZZ6 ADP 4.32692
459 4MO2 FAD 4.34783
460 4MO2 FDA 4.34783
461 1WDK NAD 4.35897
462 4HA6 FAD 4.375
463 4IV9 FAD 4.375
464 3X0D SAH 4.375
465 5E4R NAP 4.375
466 3A4T SFG 4.37956
467 5O42 BGC 4.37956
468 5O42 NAD 4.37956
469 5O42 9JW 4.37956
470 3WLE NAD 4.39883
471 3K7M FAD 4.40835
472 1P77 ATR 4.41176
473 5TOW ADN 4.4226
474 5TOW NAI 4.4226
475 5N5D SAM 4.42478
476 5CAE COA 4.47284
477 1PL6 NAD 4.49438
478 2GDZ NAD 4.49438
479 1PL6 572 4.49438
480 5NUF NAD 4.51807
481 5NUE NAD 4.51807
482 2XVM SAH 4.52261
483 1YRO UDP 4.54545
484 1ZEM NAD 4.58015
485 3ULK NDP 4.58333
486 5W7M SAH 4.58333
487 5TVA AMP 4.58333
488 2Q3M MLA 4.60123
489 4CNK FAD 4.60358
490 2FN8 RIP 4.62046
491 1YJQ NAP 4.62046
492 3H9E NAD 4.62428
493 1N2X SAM 4.65116
494 5NA1 FAD 4.65686
495 2YYY NAP 4.66472
496 4XDZ NDP 4.66472
497 1JNR FAD 4.66667
498 5TQZ GLC 4.66667
499 1XCL SAH 4.68085
500 1C0I FAD 4.6832
501 1C0I BE2 4.6832
502 3NGL NAP 4.71014
503 3NYC FAD 4.72441
504 3NYC IAR 4.72441
505 4DPL NAP 4.73538
506 5Z21 NAI 4.7486
507 5AHW CMP 4.7619
508 3OZ2 FAD 4.78589
509 1V8B NAD 4.80167
510 3B1F NAD 4.82759
511 5AYV NAP 4.85437
512 5AYV KPL 4.85437
513 2VDV SAM 4.87805
514 1TPY SAH 4.87805
515 3LST SAH 4.88506
516 5BVA FAD 4.88998
517 2FWP ICR 4.91803
518 2FWP CIT 4.91803
519 4TQG NDP 4.95356
520 1QCI ADE 4.96183
521 1F3L SAH 4.98442
522 1X14 NAD 4.98753
523 1GPE FAD 5
524 3QVP FAD 5
525 1VI2 NAD 5
526 2ZJ1 NAD 5
527 2ZJ1 ARJ 5
528 4J4H 1J1 5.01931
529 4J4H NAI 5.01931
530 4JK3 NAD 5.01931
531 1HKU NAD 5.02793
532 6ACS CIT 5.03876
533 2ZIF SAM 5.05051
534 1FK8 NAD 5.05837
535 1LDN NAD 5.06329
536 4KRI SAH 5.08083
537 1AE1 NAP 5.12821
538 3O03 NAP 5.15464
539 4LWP SAH 5.16304
540 1I8T FAD 5.17711
541 4W6Z 8ID 5.18732
542 3GDN HBX 5.20833
543 3GDN FAD 5.20833
544 2RGH FAD 5.20833
545 1NPD NAD 5.20833
546 4XZ3 COA 5.21739
547 4URF NAD 5.24194
548 1GVF PGH 5.24476
549 4RPL 3UC 5.26316
550 4RPL FAD 5.26316
551 4JLS 3ZE 5.26316
552 5F8F SFG 5.30504
553 2Q1S NAI 5.30504
554 5N6C NAD 5.33333
555 4KRG SAH 5.36481
556 3GDH SAH 5.39419
557 1KNR FAD 5.41667
558 5EB4 FAD 5.41667
559 6DNT NAD 5.41667
560 2POC BG6 5.44959
561 5F5R ANP 5.46218
562 5E72 SAM 5.49133
563 1TH8 ADP 5.51724
564 4OPC PGT 5.51876
565 4OPC FDA 5.51876
566 1P1C SAH 5.52764
567 2BZG SAH 5.60345
568 1O6Z NAD 5.61056
569 2GMH FAD 5.625
570 5MBX SP5 5.625
571 5MBX FAD 5.625
572 3UCL NAP 5.625
573 3UCL FAD 5.625
574 3UCL CYH 5.625
575 1E1M FAD 5.65217
576 1E1M NAP 5.65217
577 6CEP NAD 5.68862
578 6CEP OXM 5.68862
579 1LSS NAD 5.71429
580 5XH2 NPO 5.72519
581 2GUD BMA 5.7377
582 2HYQ MAN MAN 5.7377
583 2NUO BGC 5.7377
584 2XYQ SAH 5.7377
585 2GUD MAN 5.7377
586 2NU5 NAG 5.7377
587 2HYR BGC GLC 5.7377
588 2GUC MAN 5.7377
589 1TE2 PGA 5.75221
590 1F9V ADP 5.76369
591 2Y6Q FAD 5.77889
592 2Y6Q I7T 5.77889
593 6CI9 NAP 5.79151
594 1DJL NAP 5.7971
595 6C8R SAH 5.80475
596 1ZBQ NAD 5.8104
597 5KOK SAH 5.83333
598 1KYQ NAD 5.83942
599 3VYW SAM 5.84416
600 4TM3 FAD 5.86907
601 1ZH8 NAP 5.88235
602 5FI3 NAP 5.88235
603 3GF4 FAD 5.89744
604 3GF4 UPG 5.89744
605 3C1O NAP 5.919
606 3QWI NAP 5.92593
607 4B4U NAP 5.94059
608 5AHO TLA 5.95238
609 5ZBC FAD 5.9867
610 2XVE FAD 6.03448
611 2XVF FAD 6.03448
612 5N2I NAP 6.03448
613 4RSL FAD 6.06742
614 1VMK GUN 6.13718
615 1H82 FAD 6.14407
616 1H82 GZZ 6.14407
617 5EJ2 NAD 6.16883
618 1BW9 NAD 6.17978
619 1BXG NAD 6.17978
620 1BW9 PPY 6.17978
621 1C1X HFA 6.19718
622 1C1X NAD 6.19718
623 2QA1 FAD 6.25
624 2O07 MTA 6.25
625 2O07 SPD 6.25
626 1QD0 RR6 6.25
627 4NTC FAD 6.26866
628 5T9E NAP 6.27306
629 3MB5 SAM 6.27451
630 3VSE SAH 6.28141
631 1XTP SAI 6.29921
632 3NOJ PYR 6.30252
633 3EGI ADP 6.31068
634 2QRK AMP 6.34518
635 3G2O SAM 6.35452
636 5G3U FDA 6.38298
637 5G3U ITW 6.38298
638 4JJF FE9 6.39535
639 3WV8 ATP 6.42202
640 2IV3 UDP 6.43275
641 1I36 NAP 6.43939
642 4D3F NAP 6.45161
643 3LE7 ADE 6.51341
644 1D4O NAP 6.52174
645 3L4S NAD 6.54762
646 3L4S 3PG 6.54762
647 3WBF API 6.55738
648 3WBF NAP 6.55738
649 3ABI NAD 6.57534
650 1NVT NAP 6.62021
651 5DNK SAH 6.66667
652 3FPZ AHZ 6.74847
653 3UBM COA 6.79825
654 1PN0 IPH 6.875
655 1PN0 FAD 6.875
656 3H2B SAH 6.89655
657 6BII NAP 6.90691
658 3OA2 NAD 6.91824
659 4CQM NAP 6.96721
660 2VT3 ATP 6.97674
661 1F8G NAD 7.03125
662 2PV7 NAD 7.04698
663 2YY7 NAD 7.05128
664 43CA NPO 7.07965
665 3E1T FAD 7.08333
666 2BOY BHO 7.08661
667 2I3G NAP 7.10227
668 3GRU AMP 7.11864
669 5OFW 9TW 7.17489
670 1Q9I TEO 7.18039
671 1Q9I FAD 7.18039
672 2FK8 SAM 7.2327
673 5XNC MTA 7.27763
674 5JE8 NAD 7.28477
675 1G60 SAM 7.30769
676 1BXK NAD 7.32394
677 1EJ4 M7G 7.36842
678 3VPH NAD 7.41935
679 3VPH OXM 7.41935
680 5AOV NAP 7.44048
681 1KEW NAD 7.47922
682 2Q46 NAP 7.50988
683 5ZW3 SAH 7.55556
684 3HDY FAD 7.55667
685 3HDY FDA 7.55667
686 3HDY GDU 7.55667
687 3C3Y SAH 7.59494
688 5OF1 SAL 7.61905
689 3Q87 SAM 7.64706
690 1JG3 ADN 7.65957
691 1SC6 NAD 7.67327
692 5KKA 6V0 7.69231
693 5N0J FAD 7.70833
694 2HK9 ATR 7.70833
695 4AT0 FAD 7.70833
696 2HK9 NAP 7.70833
697 4MP8 NAD 7.70833
698 4MP8 MLI 7.70833
699 1GPM CIT 7.70833
700 4OBW SAM 7.7821
701 1E6E FAD 7.8125
702 2RHO GDP 8
703 3FPF MTA 8.05369
704 3FPF TNA 8.05369
705 5N53 8NB 8.20513
706 1ELI PYC 8.22622
707 1YKF NAP 8.23864
708 2NXE SAM 8.26772
709 1SAY PYR 8.31025
710 3LCC SAH 8.33333
711 1VE3 SAM 8.37004
712 2JHF NAD 8.55615
713 4USR FAD 8.58726
714 3TWO NDP 8.62069
715 3L9W AMP 8.71671
716 3L9W GSH 8.71671
717 1A5Z NAD 8.77743
718 1ORR NAD 8.93372
719 1REO FAD 8.95833
720 5KVA SAM 8.99281
721 1IM8 SAI 9.01639
722 5TS5 FAD 9.09091
723 1DL5 SAH 9.14826
724 3DAG FEG 9.16667
725 4L8V NAP 9.19881
726 5FJN FAD 9.21053
727 5FJN BE2 9.21053
728 3GGO NAI 9.23567
729 3GGO ENO 9.23567
730 1D4D FAD 9.26573
731 2DBZ NAP 9.28144
732 2VHW NAI 9.28382
733 3RFV NAI 9.73783
734 3RFV 15L 9.73783
735 3D3W NAP 9.83607
736 1PR9 NAP 9.83607
737 5YRF GLC GLC 9.85915
738 2G5C NAD 9.96441
739 3RGG AIR 10.0629
740 5EES NAP 10.1215
741 2D2I NAP 10.5263
742 1T26 GBD 10.559
743 1T26 NAI 10.559
744 4JCA CIT 10.7784
745 4II2 ATP 10.8434
746 5BW4 SAM 10.8614
747 1UZN NAP 10.9312
748 5OVK NDP 10.9375
749 4QTU SAM 11.1111
750 3OID NDP 11.2403
751 3G89 SAM 11.245
752 1GTE FAD 11.25
753 1EZ4 NAD 11.3208
754 5E8J SAH 11.3636
755 5BXV MGP 11.3636
756 6FDF SAH 11.3772
757 2BD0 NAP 11.4754
758 1RM4 NDP 11.5727
759 2WA2 SAM 11.5942
760 2FKA BEF 11.6279
761 5ODQ FAD 11.6667
762 1HDG NAD 11.747
763 2BOS GLA GAL GLC NBU 11.7647
764 3B20 NAD 11.7994
765 3B1J NAD 11.7994
766 1FNZ A2G 11.8143
767 2UYQ SAM 11.9355
768 5EWK P34 12
769 3RKR NAP 12.2137
770 4U8P FDA 12.2807
771 4U8P UDP 12.2807
772 1J0X NAD 12.6506
773 3QH2 3NM 12.6697
774 4YSX FAD 12.766
775 6ECT SAM 12.7726
776 4GKV NAD 12.7976
777 5BJX NAD 12.8415
778 5BJX UDP 12.8415
779 6F5Z SAH 13.1148
780 1GEG NAD 13.2812
781 1O94 ADP 13.3333
782 1DJN ADP 13.3333
783 3QV1 NAD 13.3531
784 5FUB SAH 13.3531
785 2QES ADE 13.41
786 5I39 FAD 13.4804
787 2Q1W NAD 13.5135
788 2AOT SAH 13.6986
789 1FEC FAD 13.75
790 2RGO FAD 13.75
791 2ZFU SAH 13.9535
792 5ZJ5 NAI 14.1975
793 1C3V NDP 14.2857
794 4YKG NAD 14.375
795 4YKG FAD 14.375
796 1U7T NAD 14.5594
797 1U7T TDT 14.5594
798 2HMT NAI 14.5833
799 3HAD NAD 14.6104
800 5EIN NAP 14.8148
801 1LTH NAD 15.047
802 4R6W SAH 15.1163
803 4R6W PC 15.1163
804 5YEC ATP 15.126
805 2IYL GDP 15.1408
806 2IID FAD 15.4167
807 2IID PHE 15.4167
808 4NBT NAD 15.4167
809 1RP0 AHZ 15.493
810 1QO8 FAD 15.625
811 4RQU NAD 15.7333
812 4J56 FAD 15.8333
813 2A92 NAI 16.1994
814 3SQP FAD 16.9456
815 2HQM FAD 17.3278
816 3O7W SAM 17.3469
817 1MO9 KPC 17.5
818 1MO9 FAD 17.5
819 1BZL FAD 17.5
820 1BZL GCG 17.5
821 4JNA FAD 17.9412
822 1VDC FAD 18.018
823 1L3I SAH 18.2292
824 2WPF FAD 18.5417
825 2WPF WPF 18.5417
826 5JCA FAD 18.5417
827 5JCA NDP 18.5417
828 3LZW FAD 18.6747
829 3LZW NAP 18.6747
830 3P2E SAH 19.1111
831 3QFA FAD 19.1667
832 5KMS FAD 19.375
833 5KMS NAD 19.375
834 2DC1 NAD 19.4915
835 5MIT FAD 19.5719
836 5MIT NAP 19.5719
837 6GAS FAD 19.6375
838 2NVK FAD 21.4583
839 2NVK NAP 21.4583
840 2YVF FAD 21.5686
841 2YVF NAD 21.5686
842 2YVJ FAD 21.5686
843 2YVJ NAI 21.5686
844 1FL2 FAD 22.2581
845 3LAD FAD 22.479
846 5J5Z FAD 22.5806
847 1P9P SAH 22.9885
848 5U8U FAD 23.0769
849 2RI1 GLP 23.8298
850 4EMI FAD 23.9024
851 4EMJ FAD 23.9024
852 4EMI NAD 23.9024
853 5TWB FAD 24.1279
854 3RNM FAD 24.1667
855 2F5Z FAD 24.4726
856 1V59 FAD 24.477
857 1V59 NAD 24.477
858 3AD8 NAD 24.5049
859 3AD8 FAD 24.5049
860 3AD8 PYC 24.5049
861 5L95 AMP 25
862 5LNE A2G GAL 25.6098
863 5JWC FAD 25.7198
864 5JCM FAD 25.7206
865 5JCM ISD 25.7206
866 5JCM NAD 25.7206
867 3FG2 FAD 25.9901
868 4M52 FAD 26.6094
869 4M52 M52 26.6094
870 6FP4 FAD 26.6667
871 6FP4 E1T 26.6667
872 2A8X FAD 26.7241
873 2Q7V FAD 26.875
874 1GET FAD 26.875
875 1GET NAP 26.875
876 1TDF FAD 26.8987
877 1TDF NAP 26.8987
878 4JDR FAD 27.0042
879 3ORF NAD 27.49
880 1Q1R FAD 27.7083
881 3ITJ FAD 28.1065
882 3ITJ CIT 28.1065
883 1ZK7 FAD 28.9079
884 4UP3 FAD 29.9363
885 4UP3 NDP 29.9363
886 2Q0L FAD 30.2251
887 2Q0L NAP 30.2251
888 3KLJ FAD 31.1688
889 3F8D FAD 31.5789
890 6GAR FAD 32.3782
891 3AB1 FAD 33.6111
892 1LVL FAD 35.3712
893 1LVL NAD 35.3712
894 2CDU FAD 44.5833
895 2CDU ADP 44.5833
896 3NTD FAD 46.25
897 3NT6 FAD 46.4583
898 3NTA FAD 46.6667
899 2NPX FAD 48.9933
900 2NPX NAD 48.9933
Pocket No.: 2; Query (leader) PDB : 3CGB; Ligand: FAD; Similar sites found with APoc: 39
This union binding pocket(no: 2) in the query (biounit: 3cgb.bio1) has 38 residues
No: Leader PDB Ligand Sequence Similarity
1 1P31 EPU 1.47368
2 3UDG TMP 1.66113
3 5A2Z GTP 1.66667
4 3AKI AH8 1.92308
5 6GKV SAH 1.9943
6 1U3U BNF 2.13904
7 1U3U NAD 2.13904
8 5VKT NAP 2.20994
9 2YIV YIV 2.29167
10 2XOC ADE 2.29885
11 5F1V 3VN 2.3569
12 1XHL NDP 2.3569
13 4X7G NAP 2.78884
14 4C2G ALA ALA ALA ALA 2.9148
15 6EK3 OUL 3.16742
16 3LL5 IP8 3.21285
17 1YQD NAP 3.27869
18 3I51 45C 3.33333
19 4ONQ SFG 3.36134
20 4JUI EGR 3.40426
21 2D24 XYS XYS 3.54167
22 2GMV PEP 3.54167
23 6DUB SAH 3.6036
24 3BRN SRO 3.82166
25 1Z0N BCD 4.16667
26 5MGZ SAH 4.23729
27 1YP4 ADP 4.65632
28 1WB4 SXX 5.38721
29 1USI PHE 6.06936
30 1UJ5 5RP 7.04846
31 2CUN 3PG 7.07317
32 5L3V GDP 7.35786
33 6AR9 3L4 8.08823
34 2Q28 ADP 8.125
35 2YY8 MTA 8.45771
36 5YRL GLC GLC 9.85915
37 1GEE NAD 16.4751
38 3HGM ATP 18.3673
39 1PQ7 ARG 20.0893
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