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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 1331 families. | |||||
1 | 5H1M | - | M7G | C11 H19 N5 O11 P2 | CN1CN(C2=C.... |
2 | 5THA | Kd = 140 uM | GP3 | C20 H27 N10 O18 P3 | c1nc2c(n1[.... |
3 | 5TEF | Kd = 4 uM | GTG | C21 H30 N10 O18 P3 | C[n+]1cn(c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 5H1M | - | M7G | C11 H19 N5 O11 P2 | CN1CN(C2=C.... |
2 | 5THA | Kd = 140 uM | GP3 | C20 H27 N10 O18 P3 | c1nc2c(n1[.... |
3 | 5TEF | Kd = 4 uM | GTG | C21 H30 N10 O18 P3 | C[n+]1cn(c.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GP3 | 1 | 1 |
2 | GTP | 0.921053 | 0.973684 |
3 | GSP | 0.897436 | 0.925 |
4 | GDP | 0.881579 | 0.973684 |
5 | GNH | 0.87013 | 0.961039 |
6 | G1R | 0.860759 | 0.961039 |
7 | GCP | 0.8375 | 0.948718 |
8 | 9GM | 0.82716 | 0.948718 |
9 | GNP | 0.82716 | 0.948718 |
10 | 5GP | 0.815789 | 0.960526 |
11 | G | 0.815789 | 0.960526 |
12 | GTG | 0.806818 | 0.962025 |
13 | GMV | 0.802469 | 0.948718 |
14 | G2R | 0.8 | 0.936709 |
15 | G3A | 0.797753 | 1 |
16 | G5P | 0.788889 | 1 |
17 | GP2 | 0.765432 | 0.936709 |
18 | GAV | 0.764706 | 0.936709 |
19 | Y9Z | 0.755556 | 0.880952 |
20 | GKE | 0.755556 | 0.961538 |
21 | GDC | 0.755556 | 0.961538 |
22 | GDD | 0.755556 | 0.961538 |
23 | GDR | 0.747253 | 0.961538 |
24 | GFB | 0.747253 | 0.961538 |
25 | G2P | 0.741176 | 0.936709 |
26 | 6CK | 0.73913 | 0.9375 |
27 | GPG | 0.730337 | 0.987013 |
28 | GDP BEF | 0.729412 | 0.911392 |
29 | GKD | 0.723404 | 0.961538 |
30 | JB2 | 0.723404 | 0.961538 |
31 | GTP MG | 0.72093 | 0.935065 |
32 | ALF 5GP | 0.717647 | 0.86747 |
33 | GPD | 0.715789 | 0.925926 |
34 | GDX | 0.715789 | 0.974026 |
35 | YGP | 0.706522 | 0.902439 |
36 | GDP AF3 | 0.688889 | 0.86747 |
37 | GDP ALF | 0.688889 | 0.86747 |
38 | CAG | 0.682692 | 0.904762 |
39 | JB3 | 0.68 | 0.949367 |
40 | 0O2 | 0.673913 | 0.960526 |
41 | NGD | 0.673267 | 0.987013 |
42 | GMP | 0.671053 | 0.857143 |
43 | 2MD | 0.653846 | 0.892857 |
44 | TPG | 0.645455 | 0.842697 |
45 | G3D | 0.644444 | 0.960526 |
46 | KB7 | 0.636364 | 0.807229 |
47 | MGD | 0.635514 | 0.892857 |
48 | G4P | 0.630435 | 0.960526 |
49 | GDP 7MG | 0.626263 | 0.936709 |
50 | FEG | 0.625 | 0.903614 |
51 | U2G | 0.625 | 0.9375 |
52 | GH3 | 0.619565 | 0.948052 |
53 | ZGP | 0.619048 | 0.892857 |
54 | CG2 | 0.613208 | 0.9375 |
55 | MD1 | 0.612613 | 0.892857 |
56 | PGD | 0.612613 | 0.925926 |
57 | 3GP | 0.6 | 0.922078 |
58 | DGT | 0.597826 | 0.9 |
59 | DBG | 0.587719 | 0.974359 |
60 | KBD | 0.587629 | 0.851852 |
61 | QBQ | 0.582418 | 0.960526 |
62 | FE9 | 0.575221 | 0.778947 |
63 | 6G0 | 0.569892 | 0.936709 |
64 | G1G | 0.566372 | 0.95 |
65 | KBJ | 0.564356 | 0.821429 |
66 | 2GP | 0.563218 | 0.935065 |
67 | MGP | 0.55914 | 0.936709 |
68 | GPX | 0.556701 | 0.922078 |
69 | DGI | 0.554348 | 0.9 |
70 | G4M | 0.552846 | 0.904762 |
71 | IDP | 0.549451 | 0.947368 |
72 | I2C FE2 CMO CMO | 0.547826 | 0.811111 |
73 | R5I | 0.542553 | 0.922078 |
74 | R7I | 0.542553 | 0.922078 |
75 | GTA | 0.528302 | 0.962025 |
76 | AKW | 0.522523 | 0.914634 |
77 | BGO | 0.522523 | 0.949367 |
78 | CZF | 0.521277 | 0.909091 |
79 | G1R G1R | 0.521008 | 0.949367 |
80 | BA3 | 0.516854 | 0.921053 |
81 | PGD O | 0.516667 | 0.852273 |
82 | P2G | 0.516484 | 0.860759 |
83 | B4P | 0.511111 | 0.921053 |
84 | AP5 | 0.511111 | 0.921053 |
85 | GGM | 0.508772 | 0.925926 |
86 | DG | 0.505495 | 0.8875 |
87 | DGP | 0.505495 | 0.8875 |
88 | P1G | 0.505376 | 0.85 |
89 | IMP | 0.494505 | 0.934211 |
90 | G2Q | 0.490196 | 0.936709 |
91 | AQP | 0.489362 | 0.921053 |
92 | 5FA | 0.489362 | 0.921053 |
93 | GPC | 0.483051 | 0.880952 |
94 | G C | 0.482759 | 0.901235 |
95 | ATP | 0.478723 | 0.921053 |
96 | HEJ | 0.478723 | 0.921053 |
97 | A2D | 0.477778 | 0.921053 |
98 | G7M | 0.473118 | 0.924051 |
99 | AGS | 0.46875 | 0.875 |
100 | 01G | 0.46729 | 0.903614 |
101 | HFD | 0.463918 | 0.875 |
102 | JSQ | 0.463918 | 0.875 |
103 | A4P | 0.46087 | 0.892857 |
104 | AT4 | 0.457447 | 0.886076 |
105 | APC G U | 0.455285 | 0.911392 |
106 | SGP | 0.452632 | 0.807229 |
107 | ITT | 0.452632 | 0.87013 |
108 | 35G | 0.44898 | 0.934211 |
109 | C2E | 0.44898 | 0.947368 |
110 | PCG | 0.44898 | 0.934211 |
111 | UP5 | 0.447368 | 0.898734 |
112 | ADP | 0.446809 | 0.921053 |
113 | MGO | 0.445545 | 0.843373 |
114 | 5GP 5GP | 0.444444 | 0.909091 |
115 | ANP | 0.444444 | 0.897436 |
116 | AR6 | 0.443299 | 0.896104 |
117 | APR | 0.443299 | 0.896104 |
118 | AN2 | 0.442105 | 0.909091 |
119 | PRT | 0.440367 | 0.934211 |
120 | AD9 | 0.438776 | 0.897436 |
121 | M33 | 0.4375 | 0.884615 |
122 | ACP | 0.43299 | 0.897436 |
123 | 6YZ | 0.431373 | 0.897436 |
124 | GZ0 | 0.431034 | 0.949367 |
125 | ACQ | 0.43 | 0.897436 |
126 | A1R | 0.428571 | 0.841463 |
127 | 7DT | 0.428571 | 0.907895 |
128 | T5A | 0.428571 | 0.825581 |
129 | M7G A2M G | 0.425676 | 0.831461 |
130 | CA0 | 0.42268 | 0.897436 |
131 | UCG | 0.421875 | 0.9125 |
132 | ATF | 0.421569 | 0.886076 |
133 | NYZ | 0.42 | 0.9125 |
134 | KG4 | 0.418367 | 0.897436 |
135 | ADQ | 0.415094 | 0.897436 |
136 | A3R | 0.415094 | 0.841463 |
137 | MGQ | 0.415094 | 0.961538 |
138 | HQG | 0.413462 | 0.909091 |
139 | C1Z | 0.412844 | 0.960526 |
140 | 93A | 0.412371 | 0.813953 |
141 | 6AD | 0.411765 | 0.843373 |
142 | A22 | 0.409524 | 0.934211 |
143 | 25L | 0.409091 | 0.934211 |
144 | ADX | 0.408163 | 0.811765 |
145 | AGO | 0.406504 | 0.91358 |
146 | AVV | 0.40566 | 0.831325 |
147 | 50T | 0.40404 | 0.884615 |
148 | MGV | 0.40367 | 0.914634 |
149 | 4TC | 0.403361 | 0.876543 |
150 | 4AD | 0.401869 | 0.875 |
151 | RGT | 0.401786 | 0.910256 |
152 | CGP | 0.401639 | 0.869048 |
153 | PRX | 0.4 | 0.82716 |
154 | JBT | 0.4 | 0.8 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 5tef.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |