Receptor
PDB id Resolution Class Description Source Keywords
5UAO 1.88 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF MIBH, A LATHIPEPTIDE TRYPTOPHAN 5-HALOG MICROBISPORA SP. ATCC PTA-5024 HALOGENASE LANTHIPEPTIDE TRYPTOPHAN NAI-107 OXIDOREDUCTA
Ref.: TWO FLAVOENZYMES CATALYZE THE POST-TRANSLATIONAL GE OF 5-CHLOROTRYPTOPHAN AND 2-AMINOVINYL-CYSTEINE DUR NAI-107 BIOSYNTHESIS. ACS CHEM. BIOL. V. 12 548 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:602;
D:602;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
FAD D:601;
A:601;
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
5UAO 1.88 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF MIBH, A LATHIPEPTIDE TRYPTOPHAN 5-HALOG MICROBISPORA SP. ATCC PTA-5024 HALOGENASE LANTHIPEPTIDE TRYPTOPHAN NAI-107 OXIDOREDUCTA
Ref.: TWO FLAVOENZYMES CATALYZE THE POST-TRANSLATIONAL GE OF 5-CHLOROTRYPTOPHAN AND 2-AMINOVINYL-CYSTEINE DUR NAI-107 BIOSYNTHESIS. ACS CHEM. BIOL. V. 12 548 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 5UAO - 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 217 families.
1 5UAO - 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 181 families.
1 5UAO - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
Polypharmacology
Similar Ligands
Ligand no: 1; 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 : 5UAO; Ligand: FAD; Similar sites found: 511
This union binding pocket(no: 1) in the query (biounit: 5uao.bio1) has 39 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4FWE FAD 0.00001529 0.45214 0.924214
2 1KNR FAD 0.0000007322 0.5086 1.11111
3 4N9Z V3L 0.03854 0.40789 1.14943
4 2B4R NAD 0.0001587 0.4583 1.15942
5 2B4R AES 0.0004711 0.44316 1.15942
6 1PN0 FAD 0.0000001029 0.50418 1.2939
7 1PN0 IPH 0.0000001126 0.49883 1.2939
8 2I3G NAP 0.001357 0.42257 1.42045
9 3ICT ADP 0.000001452 0.62621 1.47874
10 3ICS ADP 0.000002037 0.61878 1.47874
11 3ICR FAD 0.0000009826 0.518 1.47874
12 3ICS FAD 0.000001176 0.51153 1.47874
13 4MIG G3F 0.000005587 0.50141 1.47874
14 3ICT FAD 0.000006859 0.48846 1.47874
15 1GQ2 NAP 0.0008148 0.4368 1.47874
16 3PD6 PMP 0.02258 0.41769 1.47874
17 3PDB PMP 0.02605 0.41083 1.47874
18 2ZWA SAH 0.01573 0.40002 1.47874
19 1H82 FAD 0.00002918 0.4088 1.48305
20 4C3Y FAD 0.000004688 0.4774 1.50943
21 4C3Y ANB 0.00001451 0.44361 1.50943
22 3OZ2 FAD 0.0000002682 0.52351 1.51134
23 1GY8 NAD 0.0002683 0.44957 1.51134
24 5FTW SAH 0.017 0.40122 1.5625
25 1CDO NAD 0.0009579 0.44004 1.60428
26 2FR1 NDP 0.001215 0.42179 1.64609
27 3LU1 NAD 0.0006697 0.4372 1.64835
28 4MOP 2H5 0.000008514 0.43219 1.66359
29 3PT9 SAH 0.01075 0.41627 1.66359
30 5TUK FAD 0.000001421 0.5508 1.71569
31 1VQW FAD 0.000005873 0.5053 1.75055
32 1YY5 FAD 0.000005502 0.46199 1.75439
33 4ZCC NAI 0.00004948 0.41399 1.78571
34 4ZCC FAD 0.00004948 0.41399 1.78571
35 2GV8 FAD 0.000008176 0.49626 1.78971
36 2GVC FAD 0.000006218 0.46864 1.78971
37 2GV8 NDP 0.0004884 0.45891 1.78971
38 1YQZ FAD 0.00001427 0.40837 1.82648
39 5MQ6 NDP 0.0003537 0.4686 1.84843
40 5MST AMP 0.01372 0.42134 1.84843
41 4X1B MLI 0.02921 0.4138 1.84843
42 2GJP MAL 0.03148 0.41261 1.85567
43 3CGB FAD 0.0000003408 0.53409 1.875
44 2IYA UDP 0.02095 0.40569 1.88679
45 1E3W NAD 0.0005175 0.44157 1.91571
46 1U7T NAD 0.001455 0.42967 1.91571
47 1E6W NAD 0.001606 0.4224 1.92308
48 4JK3 NAD 0.0007067 0.44545 1.9305
49 4D3F NAP 0.0003771 0.47129 1.93548
50 2NXE SAM 0.01925 0.40443 1.9685
51 1YS4 NAP 0.002936 0.43214 1.9774
52 1W6U NAP 0.004554 0.41781 1.98676
53 3A25 SAM 0.006179 0.4275 1.99336
54 4NBU NAI 0.002498 0.41241 2
55 2CFC NAD 0.004107 0.40896 2
56 5JWC FAD 0.0000005799 0.53411 2.03327
57 1PS9 FAD 0.000001372 0.51378 2.03327
58 2GMH FAD 0.00000145 0.49335 2.03327
59 4YCA NDP 0.0006038 0.44824 2.04082
60 5E4R NAP 0.001997 0.42138 2.04082
61 3O7W SAM 0.01635 0.41754 2.04082
62 3ITJ FAD 0.000001127 0.46465 2.07101
63 1NE7 AGP 0.02451 0.40876 2.07612
64 2C29 NAP 0.005813 0.40298 2.07715
65 2V3A FAD 0.0000001252 0.5451 2.08333
66 2YX1 SFG 0.006722 0.43674 2.08333
67 4YMH SAH 0.01264 0.40702 2.08333
68 4R5M NAP 0.006607 0.40077 2.12766
69 4TQG NDP 0.0009899 0.43345 2.16718
70 3A4T SFG 0.01189 0.40539 2.18978
71 5DN9 NAD 0.001583 0.41496 2.1978
72 5TUF FAD 0.0000005377 0.54836 2.20049
73 5TUF TDC 0.000004223 0.41898 2.20049
74 3OA2 NAD 0.00583 0.40293 2.20126
75 2BRY FAD 0.0000004137 0.54811 2.21328
76 5JCM FAD 0.0000018 0.41783 2.21729
77 5JCM NAD 0.000001896 0.41501 2.21729
78 5JCM ISD 0.000001944 0.41483 2.21729
79 2HQM FAD 0.0000004147 0.50587 2.21811
80 5J7X FAD 0.000003219 0.49644 2.21811
81 4UP3 FAD 0.0000002576 0.52293 2.2293
82 4UP3 NDP 0.000487 0.46641 2.2293
83 1LJ8 NAD 0.007346 0.41462 2.23124
84 1M2W NAD 0.008479 0.40905 2.23124
85 5EB4 FAD 0.00004501 0.45955 2.25564
86 3G5S FAD 0.000004277 0.49564 2.25734
87 5TS5 FAD 0.00001384 0.46133 2.27273
88 1RSG FAD 0.000003442 0.47657 2.32558
89 2VHW NAI 0.0006244 0.42229 2.38727
90 4EUE NAI 0.0003399 0.44267 2.39234
91 3KB6 NAD 0.001246 0.43238 2.39521
92 4EIP K2C 0.0000001261 0.50411 2.40296
93 4EIP FAD 0.0000001261 0.50411 2.40296
94 1NAA 6FA 0.00005169 0.43652 2.40296
95 1F8G NAD 0.003494 0.42882 2.40296
96 1L7E NAI 0.004914 0.41641 2.40296
97 1NAA ABL 0.00004697 0.41196 2.40296
98 2IID FAD 0.00002188 0.41525 2.40964
99 2IID PHE 0.00002188 0.41525 2.40964
100 2CDU FAD 0.0000004181 0.5198 2.43363
101 2CDU ADP 0.00000128 0.41614 2.43363
102 4U00 ADP 0.0154 0.43052 2.45902
103 4OXX FMN 0.01202 0.414 2.46914
104 3CIF NAD 0.0001325 0.41486 2.50696
105 3CIF G3H 0.0007821 0.40149 2.50696
106 5LD5 NAD 0.0001427 0.48559 2.51397
107 1EZ4 NAD 0.0006421 0.44715 2.51572
108 5KOK SAH 0.012 0.41097 2.51889
109 1JG3 ADN 0.02266 0.4011 2.55319
110 2Q0L FAD 0.00000006041 0.53738 2.57235
111 2Q0L NAP 0.0004712 0.48885 2.57235
112 1DJN ADP 0.0000003767 0.59674 2.5878
113 4D04 NAP 0.000009666 0.40338 2.5878
114 4D04 FAD 0.000009666 0.40338 2.5878
115 2JJQ SAH 0.004189 0.44692 2.58824
116 5G3U FDA 0.00004823 0.45588 2.60047
117 5G3U ITW 0.0001057 0.422 2.60047
118 4K28 NAD 0.001076 0.44112 2.60223
119 3ESS 18N 0.03545 0.41473 2.6087
120 2P41 SAH 0.009359 0.41909 2.62295
121 2YYY NAP 0.003065 0.414 2.62391
122 1W8D NAP 0.00174 0.43554 2.64901
123 1W73 NAP 0.00179 0.43501 2.64901
124 4J36 1HR 0.00000004054 0.57047 2.6506
125 4J36 FAD 0.00000002647 0.54671 2.6506
126 2PS1 ORO 0.04589 0.40502 2.65487
127 2JB2 FAD 0.00000716 0.47949 2.65849
128 2JB2 PHE 0.000007863 0.47335 2.65849
129 1D1T NAD 0.0005586 0.43453 2.68097
130 1RJD SAM 0.009339 0.41292 2.69461
131 2HJR APR 0.001597 0.44037 2.7439
132 3NJ4 AFX 0.009905 0.41449 2.77264
133 3NJ4 NAD 0.0116 0.41172 2.77264
134 1GTE FAD 0.00001956 0.40836 2.77264
135 1IM8 SAI 0.01418 0.40476 2.77264
136 2A92 NAI 0.004445 0.4005 2.80374
137 2VDV SAM 0.006891 0.4362 2.84553
138 1XG5 NAP 0.004882 0.40123 2.86738
139 4JJF FE9 0.001763 0.42631 2.90698
140 4JJF N2I 0.002168 0.41732 2.90698
141 3EVG SAH 0.01714 0.40679 2.90909
142 4XDZ NDP 0.001227 0.43875 2.91545
143 1KYQ NAD 0.00003082 0.54023 2.91971
144 4RSL FAD 0.00002585 0.47143 2.92135
145 2Z3Y F2N 0.00002297 0.44637 2.95749
146 5A2Z GTP 0.02775 0.41681 2.95749
147 1QMG APX 0.008936 0.40807 2.95749
148 1YXM ADE 0.003858 0.46989 2.9703
149 3L4S NAD 0.0003441 0.44247 2.97619
150 3L4S 3PG 0.0003798 0.43801 2.97619
151 4YRY FAD 0.000004419 0.47203 2.99145
152 4YRY NAD 0.000006331 0.42985 2.99145
153 1XHC FAD 0.0000001491 0.55096 2.99728
154 1J0X NAD 0.0003029 0.43413 3.01205
155 3ABI NAD 0.00006292 0.47721 3.0137
156 1Q1R FAD 0.000001201 0.51495 3.01624
157 2VVM FAD 0.00001257 0.4668 3.0303
158 2VVL FAD 0.0000118 0.46317 3.0303
159 4NEC SAH 0.008929 0.42691 3.0303
160 3AB1 FAD 0.0000002625 0.52229 3.05556
161 1ZBQ NAD 0.001753 0.41578 3.0581
162 1G6H ADP 0.04112 0.40609 3.11284
163 5J60 FAD 0.00000004059 0.54896 3.125
164 4CJX NAP 0.0002695 0.46615 3.1348
165 3DUW SAH 0.01079 0.41308 3.13901
166 5HSA FAS 0.00001806 0.45758 3.14233
167 1TDF NAP 0.003986 0.44155 3.16456
168 1TDF FAD 0.001769 0.44019 3.16456
169 3WGT FAD 0.0000001903 0.49406 3.17003
170 3WGT QSC 0.000000344 0.48199 3.17003
171 3ZNN FAD 0.000001181 0.44136 3.17003
172 3ZNN 4WL 0.000001181 0.44136 3.17003
173 3JV7 NAD 0.002561 0.4145 3.18841
174 5E9W SAH 0.008006 0.43694 3.20513
175 1LLU NAD 0.002603 0.40464 3.21637
176 3WLE NAD 0.002374 0.40168 3.22581
177 5JJU AMP 0.03941 0.40159 3.23529
178 5LKC FUC GLA A2G 0.02046 0.40588 3.24675
179 5MZI FAD 0.000002651 0.43182 3.2538
180 5MZI FYK 0.000002826 0.42847 3.2538
181 3GDN HBX 0.00005977 0.46662 3.26296
182 3GDN FAD 0.00006906 0.45554 3.26296
183 2HK9 ATR 0.0001202 0.53559 3.27273
184 2HK9 NAP 0.001128 0.43714 3.27273
185 4GKV NAD 0.001348 0.41511 3.27381
186 4NTC FAD 0.0000001327 0.5268 3.28358
187 3A27 SAM 0.01052 0.41671 3.30882
188 1NYT NAP 0.003215 0.42132 3.32103
189 3DXY SAM 0.007045 0.43976 3.32717
190 2HNK SAH 0.01394 0.40509 3.34728
191 5BW4 SAM 0.009055 0.4231 3.37079
192 4TM3 FAD 0.0001146 0.46942 3.386
193 3EGV SAH 0.02303 0.40373 3.40136
194 4HXY NDP 0.0004959 0.43934 3.42466
195 3GFB NAD 0.001776 0.42618 3.42857
196 1MUU NAD 0.0002153 0.47021 3.44037
197 1MV8 NAD 0.000333 0.45882 3.44037
198 2BZG SAH 0.02115 0.40251 3.44828
199 1NPD NAD 0.003477 0.42279 3.47222
200 1E1M NAP 0.000006195 0.4305 3.47826
201 1E1M FAD 0.000006195 0.4305 3.47826
202 1LUA NAP 0.001843 0.44451 3.48432
203 1NVT NAP 0.001287 0.44108 3.48432
204 1WUU GLA 0.0458 0.41038 3.50877
205 1D4D FAD 0.000000285 0.5075 3.51201
206 2RGO FAD 0.000009203 0.48399 3.51201
207 4REP FAD 0.00009344 0.4424 3.51201
208 1JQ3 AAT 0.003924 0.4003 3.51201
209 1P1C SAH 0.0007487 0.45456 3.51759
210 5KKA 6V0 0.0009275 0.42621 3.52564
211 4JNA FAD 0.0000004483 0.50449 3.52941
212 2B9W FAD 0.00004579 0.47477 3.53774
213 2Q46 NAP 0.001329 0.42838 3.55731
214 3V1Y NAD 0.0001333 0.4751 3.56083
215 3LAD FAD 0.0000002721 0.51159 3.57143
216 1N4W FAD 0.00008133 0.45423 3.57143
217 1P31 EPU 0.005483 0.42992 3.57895
218 1P3D UMA 0.003574 0.41662 3.57895
219 4CNK FAD 0.0000001364 0.54382 3.58056
220 5MBX SP5 0.00004255 0.40594 3.62173
221 5MBX FAD 0.00004255 0.40594 3.62173
222 2WPF FAD 0.000003951 0.54056 3.63636
223 2WPF WPF 0.000004707 0.53956 3.63636
224 2PZM NAD 0.001312 0.41172 3.63636
225 2PZM UDP 0.001312 0.41172 3.63636
226 1VI2 NAD 0.002714 0.43364 3.66667
227 1YKF NAP 0.002446 0.41528 3.69318
228 4YNU FAD 0.00002597 0.44322 3.69686
229 4YNU LGC 0.00002359 0.4328 3.69686
230 3QWI NAP 0.003136 0.40623 3.7037
231 1E3I CXF 0.0004746 0.42653 3.7234
232 1WPQ NAD 0.005378 0.4176 3.72493
233 2AOT SAH 0.02289 0.40696 3.76712
234 2R4J FAD 0.00001211 0.4282 3.79242
235 2R4J 13P 0.00001211 0.4282 3.79242
236 1X87 NAD 0.000676 0.45647 3.81125
237 3MJE NDP 0.004579 0.40466 3.83065
238 4XDY NAI 0.0007552 0.44427 3.84615
239 5FQD LVY 0.03003 0.40767 3.8817
240 2Q1W NAD 0.0002688 0.44359 3.9039
241 1E6E FAD 0.000001168 0.5192 3.90625
242 2DKN NAI 0.002401 0.41821 3.92157
243 1PL6 NAD 0.00001614 0.53655 3.93258
244 1PL6 572 0.0001448 0.45666 3.93258
245 4FN4 NAD 0.003757 0.40801 3.93701
246 3DMH SAM 0.01699 0.40123 3.93701
247 5L4L NAP 0.01139 0.40089 3.94737
248 3UBM COA 0.01357 0.40021 3.94737
249 1V59 NAD 0.000003057 0.60986 3.9749
250 1V59 FAD 0.00000007925 0.51231 3.9749
251 2IVD FAD 0.00000438 0.49881 3.9749
252 1RYO OXL 0.01963 0.43246 3.97554
253 3NKS FAD 0.000008534 0.48513 3.98323
254 4G74 FAD 0.000001697 0.51344 3.98406
255 4G74 UQ5 0.000003818 0.45459 3.98406
256 1QO8 FAD 0.00000001473 0.58427 4.06654
257 4X9M FAD 0.0000002745 0.52191 4.06699
258 3GRU AMP 0.005991 0.41558 4.0678
259 4HA6 FAD 0.00002028 0.44827 4.13386
260 1WP4 NDP 0.001846 0.42551 4.15225
261 2CVZ NDP 0.002855 0.42062 4.15225
262 4USR FAD 0.000004513 0.50954 4.15512
263 3KLJ FAD 0.00000006908 0.57699 4.15584
264 1K3T BRZ 0.002126 0.4102 4.17827
265 1KPG SAH 0.01511 0.4008 4.18118
266 2YG3 FAD 0.00001392 0.46535 4.19426
267 1ZMD FAD 0.000000139 0.51534 4.21941
268 1ZMD NAI 0.00002843 0.5068 4.21941
269 2EV9 SKM 0.002126 0.41261 4.25139
270 2EV9 NAP 0.002126 0.41261 4.25139
271 3Q9T FAY 0.01111 0.40127 4.25139
272 1FK8 NAD 0.006896 0.40749 4.28016
273 3IHG FAD 0.0000003243 0.57137 4.29907
274 1ORR NAD 0.0004849 0.43407 4.32277
275 3GWZ SAH 0.02679 0.40362 4.33604
276 1O9P MLA 0.04457 0.40571 4.34783
277 1XA4 COA 0.01209 0.40237 4.34783
278 5U8U FAD 0.0000003532 0.43329 4.3659
279 3QJ4 FAD 0.00004666 0.45638 4.38596
280 4EMI FAD 0.0000008697 0.51606 4.39024
281 4EMI NAD 0.000001914 0.42576 4.39024
282 3FUU ADN 0.01459 0.40707 4.42804
283 3QVP FAD 0.00002371 0.44588 4.43623
284 2GLX NDP 0.003801 0.42114 4.43623
285 1EJ0 SAM 0.001284 0.45927 4.44444
286 1E5Q NDP 0.0003816 0.44984 4.44444
287 5D4V SAH 0.003757 0.42744 4.47761
288 1X14 NAD 0.0009822 0.46893 4.48878
289 2DBZ NAP 0.002717 0.41608 4.49102
290 1M26 GAL A2G 0.04933 0.40059 4.51128
291 2Y6Q FAD 0.00000006519 0.58294 4.52261
292 2Y6Q I7T 0.0000006829 0.47886 4.52261
293 2XVF FAD 0.000001822 0.50861 4.52586
294 2XVE FAD 0.000006552 0.41194 4.52586
295 1KPH SAH 0.01503 0.4009 4.52962
296 2VYN NAD 0.0001418 0.46686 4.53172
297 1Q9I FAD 0.0000000841 0.47423 4.55342
298 1Q9I TEO 0.0000000841 0.47423 4.55342
299 1ZEM NAD 0.00008129 0.48388 4.58015
300 2CVQ NDP 0.006734 0.40044 4.58716
301 2DFV NAD 0.0005378 0.44707 4.61095
302 5MSD AMP 0.01183 0.42096 4.62107
303 5MSD BEZ 0.01765 0.40328 4.62107
304 1XCL SAH 0.002913 0.40744 4.68085
305 1F06 NDP 0.002115 0.41518 4.6875
306 2NPX FAD 0.00000327 0.49972 4.69799
307 2NPX NAD 0.000005926 0.42078 4.69799
308 3G6N MET ALA SER 0.04965 0.40689 4.71204
309 1WB4 SXX 0.0267 0.42241 4.7138
310 1COY FAD 0.0001231 0.43171 4.73373
311 2D2I NAP 0.000349 0.46885 4.73684
312 5U5G NAP 0.003396 0.41224 4.74576
313 3LRE ADP 0.04949 0.40267 4.78873
314 3NTD FAD 0.000003885 0.49363 4.80591
315 3NTA FAD 0.000004448 0.4916 4.80591
316 3NT6 FAD 0.000004859 0.49027 4.80591
317 4ZRN NAD 0.0004025 0.43433 4.80769
318 2UYQ SAM 0.04494 0.40755 4.83871
319 4E5N NAD 0.00221 0.41445 4.84848
320 1IY8 NAD 0.002579 0.41187 4.86891
321 1TPY SAH 0.01323 0.40335 4.87805
322 1ZQ9 SAM 0.00517 0.43111 4.91228
323 2BD0 NAP 0.003681 0.4036 4.91803
324 5GT9 NAP 0.003839 0.40524 4.94297
325 1SC6 NAD 0.003755 0.40327 4.9505
326 3VY6 BGC BGC 0.01891 0.40937 4.96454
327 5JE8 NAD 0.001447 0.43576 4.96689
328 4USQ FAD 0.00249 0.42173 4.98615
329 3UCL FAD 0.00002245 0.49345 4.99076
330 3UCL CYH 0.00002245 0.49345 4.99076
331 3UCL NAP 0.00002724 0.49284 4.99076
332 1WDK NAD 0.0005698 0.45967 4.99076
333 4Z24 FAD 0.00001486 0.45598 4.99076
334 2DKH FAD 0.002057 0.42362 4.99076
335 2DKH 3HB 0.003208 0.42317 4.99076
336 3WV8 ATP 0.00006843 0.51336 5.04587
337 4JDR FAD 0.00000005933 0.538 5.06329
338 1RPN NDP 0.004399 0.40067 5.07463
339 3CMC NAD 0.002734 0.41638 5.08982
340 1P0F NAP 0.0008757 0.42716 5.09383
341 2EG5 SAH 0.01283 0.42278 5.10753
342 5CAE COA 0.007275 0.40917 5.11182
343 2PXX SAH 0.01646 0.40467 5.11628
344 1GUZ NAD 0.001244 0.42952 5.16129
345 3VPH NAD 0.0007125 0.42785 5.16129
346 3VPH OXM 0.001024 0.41704 5.16129
347 1Z82 NDP 0.003654 0.41356 5.1756
348 3S5W NAP 0.0005224 0.48668 5.18359
349 3S5W FAD 0.00003495 0.48349 5.18359
350 5TTJ FAD 0.000007524 0.47872 5.30612
351 3B20 NAD 0.0002034 0.47502 5.30973
352 1RKX NAD 0.003108 0.40877 5.32213
353 4CQM NAP 0.001733 0.42111 5.32787
354 1GET NAP 0.0000009714 0.54718 5.33333
355 1GET FAD 0.0000008632 0.54718 5.33333
356 2RAB FAD 0.00000009359 0.5164 5.39957
357 2RAB NAD 0.0000003609 0.43162 5.39957
358 3H2B SAH 0.01152 0.41178 5.41872
359 1I8T FAD 0.00004987 0.45125 5.44959
360 2V6G NAP 0.0002183 0.453 5.49451
361 2XYQ SAH 0.01515 0.4093 5.51724
362 3R5Z F42 0.01382 0.40251 5.51724
363 2Q7V FAD 0.0000001009 0.52993 5.53846
364 3OFK SAH 0.004422 0.43791 5.55556
365 3L9W GSH 0.0002927 0.4544 5.56901
366 3L9W AMP 0.0002576 0.45024 5.56901
367 5F8F SFG 0.01645 0.41398 5.57029
368 2CUL FAD 0.00000208 0.5141 5.60345
369 3LKZ SFG 0.01333 0.40887 5.60748
370 4XB2 HSE 0.0002861 0.4123 5.67164
371 4XB2 NDP 0.00005831 0.40601 5.67164
372 4BVA NDP 0.004353 0.40315 5.67164
373 4BV6 FAD 0.000001172 0.49611 5.67951
374 3AYI FAD 0.00002795 0.41804 5.68655
375 3AYI HCI 0.00002764 0.41559 5.68655
376 2DT5 NAD 0.0006368 0.44103 5.6872
377 1X7D NAD 0.00411 0.40895 5.71429
378 3GCZ SAM 0.007256 0.42424 5.73013
379 2F1K NAP 0.0001044 0.47943 5.73477
380 1Y8Q ATP 0.0004036 0.46242 5.78035
381 1GPE FAD 0.00003468 0.43333 5.79216
382 2X7I CIT 0.02549 0.41493 5.84416
383 5UAV TFB 0.002169 0.40307 5.90062
384 5UAV NDP 0.002169 0.40307 5.90062
385 2RGJ FAD 0.0000004841 0.54557 5.97015
386 1O94 ADP 0.00000009627 0.61582 6.06061
387 1NVM NAD 0.0008003 0.43137 6.08974
388 4XQC 13D 0.0001851 0.41515 6.10526
389 4XQC NAD 0.0003334 0.41055 6.10526
390 5GZ6 NDP 0.003972 0.42958 6.13497
391 5GZ6 7C3 0.005701 0.41651 6.13497
392 3WMX NAD 0.001553 0.43146 6.14525
393 2PT9 S4M 0.002898 0.42319 6.23053
394 4IV9 FAD 0.00005497 0.44567 6.28466
395 1FEC FAD 0.000001003 0.52552 6.32653
396 2E5V FAD 0.00000002616 0.53881 6.35593
397 4OSP NAP 0.004479 0.40747 6.46388
398 4TXI FAD 0.0000004551 0.55109 6.4695
399 2PK3 A2R 0.00847 0.4179 6.54206
400 3U31 NAD 0.01158 0.40589 6.55172
401 3NYC FAD 0.000009858 0.43398 6.56168
402 3NYC IAR 0.000009858 0.43398 6.56168
403 1J49 NAD 0.001704 0.42411 6.60661
404 2YVJ NAI 0.00001057 0.55616 6.61765
405 2YVJ FAD 0.0000008944 0.51943 6.61765
406 2YVF NAD 0.009658 0.42055 6.61765
407 2YVF FAD 0.009307 0.42055 6.61765
408 3GD4 NAD 0.0001495 0.48473 6.65362
409 3GD4 FAD 0.000005452 0.42099 6.65362
410 1LCF OXL 0.02147 0.42961 6.65434
411 5EOW FAD 0.00000001131 0.6009 6.66667
412 5ITV NAI 0.001068 0.42657 6.66667
413 3FG2 FAD 0.000000543 0.54372 6.68317
414 3G2O SAM 0.0239 0.40002 6.68896
415 4QTU SAM 0.003805 0.43378 6.73077
416 1HYH NAD 0.0009888 0.42784 6.79612
417 3EGI ADP 0.02668 0.42182 6.79612
418 3MX2 TTP 0.03096 0.40366 6.83919
419 1YJQ NAP 0.00395 0.40019 6.93069
420 4RDH AMP 0.0004181 0.49136 6.94444
421 4RDI ATP 0.001072 0.4629 6.94444
422 1CER NAD 0.00008546 0.48299 6.94864
423 2VOH CIT 0.0007232 0.51611 7.00637
424 3FAL REA 0.02525 0.41515 7.02479
425 4XFR CIT 0.04598 0.41306 7.02576
426 5JCA FAD 0.000001157 0.49071 7.04225
427 5JCA NDP 0.000003442 0.41506 7.04225
428 5TDF ADE 0.01968 0.42346 7.09877
429 3OJO NAD 0.0001695 0.48238 7.19258
430 1V8B NAD 0.001155 0.4128 7.30689
431 3QV1 NAD 0.00007407 0.48949 7.31707
432 4MO2 FDA 0.00008919 0.44946 7.33696
433 4MO2 FAD 0.0001189 0.44236 7.33696
434 1LK7 DER 0.04174 0.4003 7.42358
435 1ELI PYC 0.000109 0.44366 7.45501
436 3VYW SAM 0.01183 0.4083 7.46753
437 2OOR NAD 0.003245 0.43023 7.47126
438 4EMJ FAD 0.000001012 0.50817 7.47664
439 3S0E EOL 0.01587 0.41818 7.56302
440 4D7E FAD 0.0004587 0.42705 7.57856
441 4D79 ATP 0.0002403 0.4931 7.6087
442 2AWN ADP 0.04226 0.40788 7.61155
443 2PV7 NAD 0.001215 0.43281 7.71812
444 1JNR FAD 0.0000006025 0.5596 8
445 4RQU NAD 0.0002469 0.45733 8
446 1O5I NAD 0.01152 0.41177 8.03213
447 4GUT FAD 0.00001612 0.44015 8.06452
448 4YSX FAD 0.00000007961 0.54014 8.15603
449 4EHU ANP 0.01287 0.4012 8.33333
450 4M52 FAD 0.0000002101 0.5153 8.3691
451 2GAG NAD 0.0000003463 0.53385 8.39506
452 2GAG FOA 0.00000337 0.46513 8.39506
453 2GAG FAD 0.00000337 0.46513 8.39506
454 2A8X FAD 0.0000002245 0.50917 8.40517
455 3AD8 NAD 0.0000004399 0.54271 8.41584
456 4LWP SAH 0.007496 0.42359 8.42391
457 3G89 SAM 0.004661 0.44462 8.43373
458 2G5C NAD 0.001906 0.41951 8.54093
459 5LOG SAH 0.01249 0.41017 8.58369
460 3RNM FAD 0.0000002112 0.51013 8.62069
461 3MQ2 SAH 0.01115 0.41879 8.7156
462 1P77 ATR 0.000148 0.54468 8.82353
463 2X3N FAD 0.000001096 0.51634 9.02256
464 1XDS SAM 0.0199 0.41328 9.09091
465 1BW9 NAD 0.0003582 0.47227 9.26966
466 1C1X NAD 0.0001366 0.47465 9.29577
467 2VT3 ATP 0.0002559 0.51264 9.30233
468 2DC1 NAD 0.002334 0.42141 9.32203
469 1QZZ SAM 0.02665 0.40693 9.35829
470 2F5Z FAD 0.0000001918 0.54671 9.375
471 3GMB FAD 0.00000002166 0.59057 9.39759
472 3FPZ AHZ 0.005647 0.43866 9.5092
473 1FQJ ALF 0.04897 0.40937 9.52381
474 2XVM SAH 0.01717 0.41648 9.54774
475 3T7S SAM 0.006315 0.42706 9.70149
476 1D4O NAP 0.005718 0.40825 9.78261
477 5EVY FAD 0.0000008382 0.58177 9.81735
478 3VSE SAH 0.005646 0.44464 10.5528
479 5X20 NAD 0.001788 0.43194 10.5769
480 3H8V ATP 0.00002347 0.54005 10.9589
481 3CTY FAD 0.0000004286 0.49574 11.2853
482 1FL2 FAD 0.0000005619 0.51701 11.2903
483 5L95 AMP 0.00001216 0.54756 11.4695
484 5KMS FAD 0.0000004704 0.53323 11.6049
485 5KMS NAD 0.00001022 0.41309 11.6049
486 4KRI SAH 0.01041 0.41081 11.7783
487 3LXD FAD 0.0000008707 0.52774 11.8072
488 1BXK NAD 0.0002266 0.4588 11.831
489 5ODQ FAD 0.0000003357 0.50855 11.9565
490 4J56 FAD 0.0000001056 0.51458 12.2807
491 1O6Z NAD 0.0008794 0.44809 12.5693
492 1H5Q NAP 0.002881 0.41002 12.8302
493 1LSS NAD 0.00001052 0.54486 12.8571
494 3QFA FAD 0.0000001649 0.51939 12.931
495 5F5N NAD 0.006919 0.40486 13.1488
496 4II2 ATP 0.0002837 0.48087 13.4969
497 3MMH SME 0.03946 0.40495 14.3713
498 2V3B FAD 0.000000135 0.54818 14.5455
499 1OMO NAD 0.001005 0.44563 14.9068
500 5E8J SAH 0.008274 0.43226 15.9091
501 3SJU NDP 0.005036 0.40071 16.129
502 5N2I NAP 0.002795 0.43641 18.1034
503 5VN0 FAD 0.0000005002 0.52434 18.5328
504 5VN0 NAI 0.000005736 0.41836 18.5328
505 4GUS FAD 0.00001451 0.44929 23.8095
506 5FA5 MTA 0.01654 0.41387 25
507 5EZ7 FAD 0.00000103 0.50805 27.2959
508 1YKJ PHB 0.0000003231 0.44647 27.665
509 1YKJ FAD 0.0000003231 0.44647 27.665
510 4HSU FAD 0.00001674 0.44691 33.3333
511 2WET FAD 3.608e-18 0.86778 43.2485
Pocket No.: 2; Query (leader) PDB : 5UAO; Ligand: FAD; Similar sites found: 75
This union binding pocket(no: 2) in the query (biounit: 5uao.bio2) has 41 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1U8X NAD 0.01004 0.40017 1.27119
2 1YQT ADP 0.04866 0.40934 1.30112
3 3X0D SAH 0.0196 0.40305 1.47874
4 2ABJ CBC 0.02744 0.4019 1.91257
5 3ITJ CIT 0.0092 0.4458 2.07101
6 3F8D FAD 0.000002406 0.40515 2.16718
7 3VSV XYS 0.02551 0.42879 2.21811
8 1U1I NAD 0.003797 0.40071 2.29592
9 4YMJ 4EJ 0.04133 0.41376 2.30263
10 3OID TCL 0.02212 0.42816 2.32558
11 5MDH NAD 0.006724 0.40489 2.40296
12 5HJM MTA 0.01945 0.40321 2.55682
13 2DW7 SRT 0.02198 0.42017 2.57069
14 2ZWS PLM 0.006829 0.46551 2.5878
15 2GK6 ADP 0.04457 0.41126 2.5878
16 2HJR CIT 0.04515 0.40717 2.7439
17 2CJZ PTR 0.02077 0.42945 2.95082
18 1ZX5 LFR 0.02151 0.43175 2.95749
19 1EJB INJ 0.02732 0.402 2.97619
20 1GCK ASP PLP 0.02406 0.40467 3.11688
21 2DVZ GLU 0.04236 0.40511 3.18471
22 3IT7 TLA 0.04545 0.40126 3.2967
23 4DDS 0J7 0.03224 0.40789 3.42205
24 4DE1 0J6 0.04051 0.40276 3.42205
25 5GZ9 MAN 0.009506 0.42038 3.60656
26 4OB1 BUB 0.04311 0.41205 3.86266
27 3GU3 SAH 0.03283 0.41098 3.87324
28 1UKG MMA 0.0322 0.42153 3.96825
29 2PHF MAN MAN BMA MAN 0.03203 0.41527 3.96825
30 2PHR MAN MAN BMA MAN 0.03525 0.41301 3.96825
31 2GN3 MAN 0.03992 0.40258 3.96825
32 5GUD NDP 0.001727 0.40235 4.03397
33 5GUD 2IT 0.002524 0.40075 4.03397
34 3KRL KRL 0.0158 0.40456 4.1791
35 1T9D P22 0.028 0.42249 4.25139
36 5TE1 7A2 0.02543 0.42069 4.25139
37 4FK7 P34 0.03359 0.41377 4.36681
38 1OBB NAD 0.01056 0.40425 4.375
39 1LDN NAD 0.0002228 0.40562 4.43038
40 1O8B ABF 0.03169 0.41552 4.56621
41 5A1S FLC 0.03421 0.41706 4.80591
42 5EYW PGA 0.04586 0.4068 4.81928
43 1PZG A3D 0.00208 0.40372 5.13595
44 5SXS NIZ 0.03038 0.41232 5.1756
45 1NML CIT 0.02746 0.42296 5.21472
46 2OUA AES 0.0439 0.40028 5.31915
47 1FQK ALF 0.03912 0.41693 5.44218
48 4JBI NDP 0.01168 0.40236 5.94595
49 1MZC SUC 0.02042 0.42583 5.94966
50 3I53 SAH 0.01892 0.40099 6.0241
51 3HBN UDP 0.02759 0.40179 6.38298
52 2BES RES 0.01793 0.42101 6.39535
53 3N8K D1X 0.03357 0.41046 6.39535
54 1VM6 NAD 0.01028 0.40221 6.57895
55 3W6X HZP 0.04591 0.40983 6.9869
56 3LTW HLZ 0.0372 0.41501 7.14286
57 1M2O GNP 0.01093 0.40361 7.36842
58 1KEV NDP 0.003892 0.40032 7.40741
59 3P7G MAN 0.03876 0.4045 7.53425
60 5MGZ SAH 0.02045 0.40221 7.62712
61 4OOE NDP 0.006524 0.40792 7.67327
62 3OTH TYD 0.03261 0.40123 8.25243
63 3AD8 PYC 0.00001111 0.40184 8.41584
64 3AD8 FAD 0.00001111 0.40184 8.41584
65 4ZNO SUC 0.02763 0.40737 8.65672
66 2BTM PGA 0.03132 0.4158 8.73016
67 4YMZ 13P 0.02052 0.42571 9.16335
68 1US5 GLU 0.02426 0.41426 10.1911
69 1XXR MAN 0.03696 0.40709 10.559
70 4NAE 1GP 0.04772 0.4093 11.1111
71 1YQC GLV 0.005902 0.45952 11.1765
72 3EF0 ALF 0.01459 0.43125 12.9032
73 3OQJ 3CX 0.03273 0.41874 13.2296
74 1UY4 XYP XYP XYP XYP 0.04625 0.40429 15.8621
75 2BS3 CIT 0.02774 0.4047 16.0156
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