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Receptor
PDB id Resolution Class Description Source Keywords
1E62 2.3 Å EC: 1.18.1.2 FERREDOXIN:NADP+ REDUCTASE MUTANT WITH LYS 75 REPLACED BY ARG (K75R) NOSTOC SP. PCC 7119 OXIDOREDUCTASE FLAVOPROTEIN NADP FAD FNR NADP REDUCTASE
Ref.: STRUCTURAL ANALYSIS OF INTERACTIONS FOR COMPLEX FORMATION BETWEEN FERREDOXIN-NADP+ REDUCTASE AND ITS PROTEIN PARTNERS. PROTEINS V. 59 592 2005
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FAD A:304;
Valid;
none;
submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
SO4 A:307;
Invalid;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2BSA 1.92 Å EC: 1.18.1.2 FERREDOXIN-NADP REDUCTASE (MUTATION: Y 303 S) COMPLEXED WITH NADP ANABAENA SP. OXIDOREDUCTASE FAD FLAVOPROTEIN FNR MEMBRANE NADP NADP REDUCTASE PHYCOBILISOME THYLAKOID
Ref.: C-TERMINAL TYROSINE OF FERREDOXIN-NADP(+) REDUCTASE IN HYDRIDE TRANSFER PROCESSES WITH NAD(P)(+)/H. BIOCHEMISTRY V. 44 13477 2005
Members (30)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 25 families.
1 1E63 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
2 1H42 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
3 1E62 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
4 1H85 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
5 2X3U - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
6 1B2R - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 1GO2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
8 1QUE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
9 4C43 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
10 1E64 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
11 3ZC3 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
12 1GR1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
13 1QGY - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 1QGZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
15 3ZBT - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 2BSA Kd < 0.01 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
17 1W34 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
18 2VZL Kd = 550 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
19 1QH0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
20 1BQE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
21 1OGJ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
22 1BJK - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
23 1OGI - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 1W35 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
25 4BPR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
26 1GJR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
27 2BMW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
28 2VYQ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
29 3ZBU - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
30 1QUF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (45)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 17 families.
1 1QFZ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
2 1QFY Kd < 0.2 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 1QGA Kd = 5.5 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
4 1QG0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
5 1E63 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
6 1H42 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 1E62 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
8 1H85 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
9 2X3U - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
10 1B2R - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
11 1GO2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
12 1QUE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
13 4C43 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 1E64 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
15 3ZC3 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 1GR1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
17 1QGY - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
18 1QGZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
19 3ZBT - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
20 2BSA Kd < 0.01 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
21 1W34 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
22 2VZL Kd = 550 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
23 1QH0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 1BQE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
25 1OGJ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
26 1BJK - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
27 1OGI - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
28 1W35 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
29 4BPR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
30 1GJR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
31 2BMW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
32 2VYQ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
33 3ZBU - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
34 1QUF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
35 1GAW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
36 1FNB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
37 1BX1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
38 1FRN - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
39 1FNC - FDA C27 H35 N9 O15 P2 Cc1cc2c(cc....
40 1FRQ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
41 1BX0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
42 1FND - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
43 1SM4 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
44 3VO2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
45 3VO1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
50% Homology Family (60)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 9 families.
1 1JB9 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
2 5VW9 - NCA C6 H6 N2 O c1cc(cnc1)....
3 5VW8 Kd < 0.02 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
4 5H59 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
5 5VW3 Kd < 0.02 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
6 5VW6 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
7 3LO8 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
8 5VWA - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
9 3LVB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
10 5VW4 - NCA C6 H6 N2 O c1cc(cnc1)....
11 5VW7 - FDA C27 H35 N9 O15 P2 Cc1cc2c(cc....
12 5VWB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
13 5VW2 Kd < 0.02 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
14 5VW5 - NCA C6 H6 N2 O c1cc(cnc1)....
15 2RC5 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 1QFZ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
17 1QFY Kd < 0.2 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
18 1QGA Kd = 5.5 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
19 1QG0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
20 1E63 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
21 1H42 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
22 1E62 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
23 1H85 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 2X3U - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
25 1B2R - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
26 1GO2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
27 1QUE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
28 4C43 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
29 1E64 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
30 3ZC3 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
31 1GR1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
32 1QGY - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
33 1QGZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
34 3ZBT - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
35 2BSA Kd < 0.01 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
36 1W34 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
37 2VZL Kd = 550 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
38 1QH0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
39 1BQE - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
40 1OGJ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
41 1BJK - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
42 1OGI - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
43 1W35 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
44 4BPR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
45 1GJR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
46 2BMW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
47 2VYQ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
48 3ZBU - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
49 1QUF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50 1GAW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
51 1FNB - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
52 1BX1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
53 1FRN - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
54 1FNC - FDA C27 H35 N9 O15 P2 Cc1cc2c(cc....
55 1FRQ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
56 1BX0 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
57 1FND - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
58 1SM4 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
59 3VO2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
60 3VO1 - 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 : 2BSA; Ligand: FAD; Similar sites found with APoc: 146
This union binding pocket(no: 1) in the query (biounit: 2bsa.bio1) has 50 residues
No: Leader PDB Ligand Sequence Similarity
1 2CHT TSA None
2 2ALG DAO 1.32013
3 4ZDM GLY 1.91571
4 1USR SIA 1.9802
5 1FUR MLT 2.31023
6 3PUN FUC GAL NDG FUC 2.31023
7 4BTV RB3 2.31023
8 6F5W KG1 2.31023
9 5G48 1FL 2.31023
10 4L9Z COA 2.31023
11 2HJR APR 2.31023
12 3FIU POP 2.40964
13 5TCI MLI 2.53623
14 4F07 FAD 2.63158
15 2X1L ADN 2.64026
16 2D3N GLC GLC GLC 2.64026
17 4C2C ALA ALA ALA 2.64026
18 1EP2 FAD 2.68199
19 3RK0 AMP 2.95359
20 3RK1 ATP 2.95359
21 4PZ6 GMP 2.9703
22 3BP1 GUN 3.10345
23 3T50 FMN 3.125
24 2WBV SIA 3.1746
25 5H9Y BGC BGC BGC BGC BGC 3.30033
26 3UNG ADP 3.30033
27 1RJW ETF 3.30033
28 3QSB 743 3.30033
29 1XNG ATP 3.30033
30 4G6I RS3 3.33333
31 5WHU SIA GAL GLC 3.3557
32 5VYQ FON 3.52941
33 3QH2 3NM 3.61991
34 3PGU OLA 3.63036
35 2GJP MAL 3.63036
36 2WPB ZZI 3.63036
37 4IXH IMP 3.63036
38 2ASF CIT 3.64964
39 1T9M FMN 3.73832
40 3BY9 SIN 3.84615
41 1Y7P RIP 4.03587
42 1XVB BHL 4.11765
43 2OWZ CIT 4.29043
44 1YFS ALA 4.29043
45 6A4R ASP 4.5283
46 1LUA NAP 4.52962
47 1VHZ APR 4.54545
48 2JLD ALA GLY GLY ALA ALA ALA ALA ALA 4.62046
49 5VKM GAL SIA 4.62046
50 1GPM AMP 4.62046
51 5VMC SIA GAL NAG 4.71204
52 3FSY SCA 4.81928
53 4LO6 SIA GAL 4.9505
54 3JQ3 ADP 4.9505
55 6EZ6 C5Z 4.9505
56 1T5B FMN 4.97512
57 1SU2 ATP 5.03145
58 2BVE PH5 5.04202
59 3LRE ADP 5.28053
60 6BE3 NAG 5.52995
61 1KC7 PPR 5.61056
62 5JCA FAD 5.6338
63 1KZL CRM 5.76923
64 4RYV ZEA 5.80645
65 5LKC FUC GLA A2G 5.94059
66 5U97 PIT 5.94059
67 6GEH FAD 6.25
68 6B2M COA 6.29371
69 5WHT SIA GAL 6.52174
70 5WHT SIA 6.52174
71 4YRY NAD 6.60066
72 4YRY FAD 6.60066
73 4DS0 A2G GAL NAG FUC 6.60066
74 4KBA 1QM 6.60066
75 5JIB OIA 6.60066
76 5W4W 9WG 6.60066
77 2E1A MSE 6.66667
78 1RZU ADP 6.93069
79 4MO4 ACP 6.93069
80 1G8S MET 6.93069
81 4ONT SIA GAL BGC 6.97674
82 5YSI NCA 7.23684
83 2WEL K88 7.33333
84 2PIA FMN 7.59076
85 1Q19 APC 7.59076
86 4HMX WUB 7.90698
87 4HMX FMN 7.90698
88 1E5Q SHR 7.92079
89 5N2D 8J8 8.33333
90 4YHB FAD 8.79121
91 3OZV FAD 8.91089
92 3OZV ECN 8.91089
93 1KQR MNA 9.49721
94 1F9V ADP 9.57096
95 2YYE APC 9.57096
96 3UEC ALA ARG TPO LYS 9.58904
97 3A3B FMN 10
98 3A3B RBF 10
99 1NE7 16G 10.0346
100 2EB5 OXL 10.1124
101 5F6U 5VK 10.1911
102 4CP8 MLI 10.2669
103 2QGI UDP 10.4839
104 3B99 U51 11.2211
105 2RDG NDG FUC SIA GAL 11.7347
106 1PVC ILE SER GLU VAL 11.7647
107 4WQM FAD 12.8713
108 5FUI APY 12.8788
109 2XG5 EC2 13.2948
110 2XG5 EC5 13.2948
111 5UCD NAP 13.8614
112 5O0X FAD 14.433
113 4G1V FAD 19.1419
114 5AHW CMP 19.7279
115 4AG5 ADP 21.4521
116 5YLY FAD 21.5753
117 1QX4 FAD 22.6277
118 1A8P FAD 22.8682
119 1N13 AG2 23.0089
120 2QQC AG2 23.2143
121 3W2E FAD 23.2472
122 3W2E NAD 23.2472
123 2CND FAD 23.3333
124 2QTZ FAD 23.4323
125 2QTZ NAP 23.4323
126 4U9U FAD 24.5552
127 5OGX FAD 24.7525
128 3IWD M2T 25.8065
129 2EIX FAD 26.3374
130 4DQL NAP 29.703
131 4DQL FAD 29.703
132 1TLL FAD 32.6733
133 1F20 NAP 32.6733
134 1TLL NAP 32.6733
135 1F20 FAD 32.6733
136 1KRH FAD 33.3333
137 3CRZ NAP 34.3234
138 3CRZ FAD 34.3234
139 3FJO FAD 34.9835
140 5FA6 FAD 34.9835
141 5FA6 FMN 34.9835
142 5FA6 NAP 34.9835
143 3QFS FAD 35.3135
144 3QFS NAP 35.3135
145 1DDG FAD 35.6436
146 5GXU FAD 38.9439
Pocket No.: 2; Query (leader) PDB : 2BSA; Ligand: NAP; Similar sites found with APoc: 164
This union binding pocket(no: 2) in the query (biounit: 2bsa.bio1) has 51 residues
No: Leader PDB Ligand Sequence Similarity
1 2CHT TSA None
2 2ALG DAO 1.32013
3 4ZDM GLY 1.91571
4 1USR SIA 1.9802
5 3MQ2 SAH 2.29358
6 1FUR MLT 2.31023
7 3PUN FUC GAL NDG FUC 2.31023
8 4BTV RB3 2.31023
9 6F5W KG1 2.31023
10 5G48 1FL 2.31023
11 4L9Z COA 2.31023
12 2HJR APR 2.31023
13 3FIU POP 2.40964
14 5TCI MLI 2.53623
15 4F07 FAD 2.63158
16 2D3N GLC GLC GLC 2.64026
17 4C2C ALA ALA ALA 2.64026
18 2YK7 CSF 2.64026
19 1EP2 FAD 2.68199
20 3RK0 AMP 2.95359
21 3RK1 ATP 2.95359
22 3RKR NAP 3.05344
23 3BP1 GUN 3.10345
24 3T50 FMN 3.125
25 2WBV SIA 3.1746
26 5H9Y BGC BGC BGC BGC BGC 3.30033
27 3UNG ADP 3.30033
28 1RJW ETF 3.30033
29 3QSB 743 3.30033
30 1XNG ATP 3.30033
31 4AZW SAM 3.30033
32 4G6I RS3 3.33333
33 5WHU SIA GAL GLC 3.3557
34 5VYQ FON 3.52941
35 1LSS NAD 3.57143
36 3QH2 3NM 3.61991
37 2WPB ZZI 3.63036
38 4BWL MN9 3.63036
39 3PGU OLA 3.63036
40 4IXH IMP 3.63036
41 5EES NAP 3.64372
42 2ASF CIT 3.64964
43 1T9M FMN 3.73832
44 1F74 NAY 3.75427
45 3BY9 SIN 3.84615
46 1K0D GSH 3.84615
47 4LWP SAH 3.9604
48 1Y7P RIP 4.03587
49 2OWZ CIT 4.29043
50 1YFS ALA 4.29043
51 5OVK NDP 4.29688
52 5B5S BOG 4.34783
53 5KZD RCJ 4.43686
54 6A4R ASP 4.5283
55 1LUA NAP 4.52962
56 1VHZ APR 4.54545
57 2JLD ALA GLY GLY ALA ALA ALA ALA ALA 4.62046
58 5VKM GAL SIA 4.62046
59 1GPM AMP 4.62046
60 4EIL CB3 4.62046
61 2IRY DGT 4.62046
62 5VMC SIA GAL NAG 4.71204
63 3FSY SCA 4.81928
64 5K7U SAM 4.88889
65 3SIX GDP 4.9505
66 4LO6 SIA GAL 4.9505
67 6EZ6 C5Z 4.9505
68 1B1C FMN 4.97238
69 1T5B FMN 4.97512
70 1SU2 ATP 5.03145
71 2BVE PH5 5.04202
72 5IL1 SAM 5.18868
73 3LRE ADP 5.28053
74 6BE3 NAG 5.52995
75 2Z4T C5P 5.61056
76 1KC7 PPR 5.61056
77 5JCA FAD 5.6338
78 1KZL CRM 5.76923
79 4RYV ZEA 5.80645
80 5U97 PIT 5.94059
81 5LKC FUC GLA A2G 5.94059
82 6GEH FAD 6.25
83 6B2M COA 6.29371
84 5WHT SIA GAL 6.52174
85 5WHT SIA 6.52174
86 4YRY NAD 6.60066
87 4YRY FAD 6.60066
88 4DS0 A2G GAL NAG FUC 6.60066
89 4KBA 1QM 6.60066
90 5W4W 9WG 6.60066
91 2E1A MSE 6.66667
92 1RZU ADP 6.93069
93 4XWM CBK 6.93069
94 4MO4 ACP 6.93069
95 1G8S MET 6.93069
96 4ONT SIA GAL BGC 6.97674
97 5YSI NCA 7.23684
98 3CB2 GDP 7.26073
99 2WEL K88 7.33333
100 2PIA FMN 7.59076
101 1Q19 APC 7.59076
102 4HMX WUB 7.90698
103 4HMX FMN 7.90698
104 1E5Q SHR 7.92079
105 5N2D 8J8 8.33333
106 4YHB FAD 8.79121
107 3OZV FAD 8.91089
108 3OZV ECN 8.91089
109 1KQR MNA 9.49721
110 1F9V ADP 9.57096
111 2YYE APC 9.57096
112 3UEC ALA ARG TPO LYS 9.58904
113 5DYO FLU 9.90099
114 3A3B FMN 10
115 3A3B RBF 10
116 1NE7 16G 10.0346
117 2EB5 OXL 10.1124
118 5F6U 5VK 10.1911
119 4CP8 MLI 10.2669
120 2QGI UDP 10.4839
121 5C9J STE 11.1111
122 3B99 U51 11.2211
123 2RDG NDG FUC SIA GAL 11.7347
124 1PVC ILE SER GLU VAL 11.7647
125 4WQM FAD 12.8713
126 5FUI APY 12.8788
127 2XG5 EC2 13.2948
128 2XG5 EC5 13.2948
129 5UCD NAP 13.8614
130 5O0X FAD 14.433
131 4G1V FAD 19.1419
132 5AHW CMP 19.7279
133 4AG5 ADP 21.4521
134 5YLY FAD 21.5753
135 1QX4 FAD 22.6277
136 1A8P FAD 22.8682
137 1N13 AG2 23.0089
138 2QQC AG2 23.2143
139 3W2E FAD 23.2472
140 3W2E NAD 23.2472
141 2CND FAD 23.3333
142 2QTZ FAD 23.4323
143 2QTZ NAP 23.4323
144 4U9U FAD 24.5552
145 5OGX FAD 24.7525
146 3IWD M2T 25.8065
147 2EIX FAD 26.3374
148 4DQL NAP 29.703
149 4DQL FAD 29.703
150 1TLL FAD 32.6733
151 1F20 NAP 32.6733
152 1TLL NAP 32.6733
153 1F20 FAD 32.6733
154 1KRH FAD 33.3333
155 3CRZ NAP 34.3234
156 3CRZ FAD 34.3234
157 3FJO FAD 34.9835
158 5FA6 FMN 34.9835
159 5FA6 FAD 34.9835
160 5FA6 NAP 34.9835
161 3QFS FAD 35.3135
162 3QFS NAP 35.3135
163 1DDG FAD 35.6436
164 5GXU FAD 38.9439
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