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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 59 families. | |||||
1 | 4A61 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
2 | 2ZGY | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
3 | 1MWM | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
4 | 2ZGZ | - | GNP | C10 H17 N6 O13 P3 | c1nc2c(n1[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 40 families. | |||||
1 | 4A61 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
2 | 2ZGY | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
3 | 1MWM | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
4 | 2ZGZ | - | GNP | C10 H17 N6 O13 P3 | c1nc2c(n1[.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 9GM | 1 | 1 |
2 | GNP | 1 | 1 |
3 | GDP | 0.839506 | 0.973684 |
4 | GP3 | 0.82716 | 0.948718 |
5 | GTP | 0.809524 | 0.973684 |
6 | GNH | 0.807229 | 0.986842 |
7 | GCP | 0.77907 | 0.948718 |
8 | G1R | 0.77907 | 0.961039 |
9 | GSP | 0.770115 | 0.925 |
10 | 5GP | 0.756098 | 0.960526 |
11 | G | 0.756098 | 0.960526 |
12 | G2R | 0.747253 | 0.936709 |
13 | GMV | 0.747126 | 0.948718 |
14 | GAV | 0.714286 | 0.936709 |
15 | GP2 | 0.712644 | 0.936709 |
16 | G2P | 0.711111 | 0.936709 |
17 | Y9Z | 0.708333 | 0.880952 |
18 | GDD | 0.690722 | 0.936709 |
19 | GKE | 0.690722 | 0.936709 |
20 | GDC | 0.690722 | 0.936709 |
21 | G5P | 0.686869 | 0.948718 |
22 | GPG | 0.684211 | 0.936709 |
23 | GFB | 0.683673 | 0.936709 |
24 | GDR | 0.683673 | 0.936709 |
25 | GTG | 0.683673 | 0.91358 |
26 | GDP BEF | 0.681319 | 0.911392 |
27 | GKD | 0.68 | 0.936709 |
28 | JB2 | 0.68 | 0.936709 |
29 | 6CK | 0.676768 | 0.91358 |
30 | G3A | 0.676768 | 0.948718 |
31 | GTP MG | 0.673913 | 0.935065 |
32 | GDX | 0.673267 | 0.948718 |
33 | ALF 5GP | 0.67033 | 0.86747 |
34 | YGP | 0.663265 | 0.879518 |
35 | GPD | 0.656863 | 0.902439 |
36 | GDP AF3 | 0.645833 | 0.86747 |
37 | GDP ALF | 0.645833 | 0.86747 |
38 | JB3 | 0.641509 | 0.925 |
39 | DBG | 0.640351 | 0.974359 |
40 | G3D | 0.638298 | 0.960526 |
41 | G4P | 0.625 | 0.960526 |
42 | GMP | 0.621951 | 0.857143 |
43 | NGD | 0.62037 | 0.936709 |
44 | GGM | 0.618182 | 0.925926 |
45 | 0O2 | 0.616162 | 0.960526 |
46 | KB7 | 0.612903 | 0.807229 |
47 | 2MD | 0.603604 | 0.870588 |
48 | CAG | 0.60177 | 0.904762 |
49 | FEG | 0.590909 | 0.858824 |
50 | U2G | 0.590909 | 0.91358 |
51 | GDP 7MG | 0.590476 | 0.888889 |
52 | MGD | 0.587719 | 0.870588 |
53 | ZGP | 0.585586 | 0.848837 |
54 | CG2 | 0.580357 | 0.91358 |
55 | KBD | 0.568627 | 0.807229 |
56 | ANP | 0.568421 | 0.922078 |
57 | PGD | 0.567797 | 0.902439 |
58 | MD1 | 0.567797 | 0.870588 |
59 | 3GP | 0.56044 | 0.922078 |
60 | TPG | 0.558333 | 0.822222 |
61 | GH3 | 0.55 | 0.948052 |
62 | KBJ | 0.54717 | 0.77907 |
63 | FE9 | 0.546219 | 0.778947 |
64 | GPX | 0.539216 | 0.922078 |
65 | G4M | 0.539062 | 0.860465 |
66 | DGI | 0.536082 | 0.9 |
67 | BGO | 0.535088 | 0.901235 |
68 | IDP | 0.53125 | 0.947368 |
69 | DGT | 0.53 | 0.9 |
70 | 2GP | 0.526882 | 0.935065 |
71 | G1R G1R | 0.520325 | 0.901235 |
72 | QBQ | 0.515152 | 0.960526 |
73 | I2C FE2 CMO CMO | 0.508197 | 0.811111 |
74 | AGO | 0.504202 | 0.91358 |
75 | P2G | 0.5 | 0.860759 |
76 | G1G | 0.5 | 0.902439 |
77 | MGP | 0.49505 | 0.936709 |
78 | R5I | 0.49505 | 0.922078 |
79 | R7I | 0.49505 | 0.922078 |
80 | PGD O | 0.492063 | 0.831461 |
81 | 6G0 | 0.490196 | 0.936709 |
82 | P1G | 0.489796 | 0.85 |
83 | AKW | 0.483051 | 0.869048 |
84 | DG | 0.474227 | 0.8875 |
85 | DGP | 0.474227 | 0.8875 |
86 | IMP | 0.463918 | 0.934211 |
87 | G2Q | 0.462963 | 0.936709 |
88 | CZF | 0.460784 | 0.909091 |
89 | GPC | 0.459677 | 0.858824 |
90 | G C | 0.459016 | 0.878049 |
91 | GTA | 0.448276 | 0.91358 |
92 | G7M | 0.444444 | 0.924051 |
93 | MAP | 0.439252 | 0.898734 |
94 | B4P | 0.434343 | 0.871795 |
95 | ADP | 0.434343 | 0.896104 |
96 | AP5 | 0.434343 | 0.871795 |
97 | A2D | 0.43299 | 0.871795 |
98 | AT4 | 0.43 | 0.8625 |
99 | SGP | 0.425743 | 0.807229 |
100 | AU1 | 0.425743 | 0.922078 |
101 | BA3 | 0.424242 | 0.871795 |
102 | APC G U | 0.423077 | 0.864198 |
103 | C2E | 0.423077 | 0.897436 |
104 | 35G | 0.423077 | 0.909091 |
105 | PCG | 0.423077 | 0.909091 |
106 | HEJ | 0.421569 | 0.896104 |
107 | ATP | 0.421569 | 0.896104 |
108 | ACQ | 0.419048 | 0.873418 |
109 | 5GP 5GP | 0.419048 | 0.860759 |
110 | AQP | 0.417476 | 0.896104 |
111 | 5FA | 0.417476 | 0.896104 |
112 | 01G | 0.417391 | 0.880952 |
113 | UNP | 0.415842 | 0.810127 |
114 | AN2 | 0.415842 | 0.909091 |
115 | 6AD | 0.415094 | 0.821429 |
116 | M33 | 0.411765 | 0.860759 |
117 | ITT | 0.411765 | 0.846154 |
118 | JSQ | 0.409524 | 0.851852 |
119 | HFD | 0.409524 | 0.851852 |
120 | ACP | 0.407767 | 0.873418 |
121 | KG4 | 0.407767 | 0.873418 |
122 | 6YZ | 0.407407 | 0.873418 |
123 | AR6 | 0.403846 | 0.871795 |
124 | APR | 0.403846 | 0.871795 |
125 | A4P | 0.403226 | 0.848837 |
126 | UCG | 0.402985 | 0.888889 |
127 | M7G A2M G | 0.4 | 0.791209 |
128 | AD9 | 0.4 | 0.873418 |
129 | AGS | 0.4 | 0.851852 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | BEF GDP | 0.9966 |
2 | ALF GDP | 0.9853 |
3 | BEF ADP | 0.9788 |
4 | DTP | 0.9719 |
5 | ADP BEF | 0.9564 |
6 | ADP ALF | 0.9518 |
7 | GDP MG | 0.9489 |
8 | ADP AF3 | 0.9407 |
9 | UTP | 0.9203 |
10 | ADP MG | 0.9170 |
11 | CTP | 0.9164 |
12 | ATF | 0.9160 |
13 | MGT | 0.9145 |
14 | P5A | 0.9069 |
15 | APC | 0.8983 |
16 | AMO | 0.8940 |
17 | DSZ | 0.8934 |
18 | SSA | 0.8828 |
19 | TSB | 0.8826 |
20 | A12 | 0.8814 |
21 | ATP MG | 0.8808 |
22 | 8X1 | 0.8806 |
23 | PR8 | 0.8796 |
24 | DAT | 0.8750 |
25 | 5AL | 0.8746 |
26 | MGO | 0.8726 |
27 | NSS | 0.8721 |
28 | G5A | 0.8710 |
29 | 3AT | 0.8675 |
30 | SRP | 0.8665 |
31 | SAM | 0.8658 |
32 | TAT | 0.8655 |
33 | A5A | 0.8651 |
34 | 4AD | 0.8639 |
35 | KAA | 0.8631 |
36 | 8DG | 0.8607 |
37 | VO4 ADP | 0.8602 |
38 | GCP G | 0.8590 |
39 | ADX | 0.8588 |
40 | ANP MG | 0.8566 |
41 | TTP | 0.8526 |
This union binding pocket(no: 1) in the query (biounit: 2zgy.bio3) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2zgy.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 2zgy.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 2zgy.bio2) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |