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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 2 families. | |||||
1 | 1XX4 | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
2 | 1SG4 | - | CO8 | C29 H50 N7 O17 P3 S | CCCCCCCC(=.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 1XX4 | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
2 | 1SG4 | - | CO8 | C29 H50 N7 O17 P3 S | CCCCCCCC(=.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | CO8 | 1 | 1 |
2 | 5F9 | 0.992126 | 1 |
3 | MYA | 0.992126 | 1 |
4 | DCC | 0.992126 | 1 |
5 | MFK | 0.992126 | 1 |
6 | ST9 | 0.992126 | 1 |
7 | UCC | 0.992126 | 1 |
8 | HXC | 0.953125 | 1 |
9 | BCO | 0.884615 | 0.977528 |
10 | YNC | 0.869565 | 0.945055 |
11 | HDC | 0.868613 | 1 |
12 | GRA | 0.865672 | 0.955556 |
13 | 1HE | 0.856061 | 0.956044 |
14 | 1VU | 0.854962 | 0.988764 |
15 | SCA | 0.843284 | 0.955556 |
16 | IVC | 0.842105 | 0.966292 |
17 | 3HC | 0.842105 | 0.966292 |
18 | CS8 | 0.834532 | 0.988889 |
19 | MLC | 0.828358 | 0.955556 |
20 | ACO | 0.824427 | 0.988764 |
21 | HGG | 0.823529 | 0.955556 |
22 | MRR | 0.822695 | 1 |
23 | MRS | 0.822695 | 1 |
24 | CAA | 0.822222 | 0.966292 |
25 | NHW | 0.815603 | 0.977778 |
26 | UOQ | 0.815603 | 0.977778 |
27 | NHM | 0.815603 | 0.977778 |
28 | 0ET | 0.814286 | 0.977778 |
29 | 3KK | 0.81203 | 0.977528 |
30 | 8Z2 | 0.811189 | 0.988889 |
31 | CAO | 0.80916 | 0.923913 |
32 | COS | 0.80916 | 0.934066 |
33 | OXK | 0.80597 | 0.955556 |
34 | FAQ | 0.804348 | 0.955556 |
35 | 0T1 | 0.8 | 0.955056 |
36 | CO6 | 0.8 | 0.977528 |
37 | 2MC | 0.794118 | 0.935484 |
38 | TGC | 0.792857 | 0.945055 |
39 | FYN | 0.785185 | 0.955056 |
40 | DCA | 0.784615 | 0.955056 |
41 | MCA | 0.782609 | 0.966667 |
42 | COO | 0.782609 | 0.955556 |
43 | SOP | 0.779412 | 0.955556 |
44 | COK | 0.779412 | 0.934066 |
45 | MC4 | 0.776978 | 0.925532 |
46 | YXS | 0.776978 | 0.887755 |
47 | YXR | 0.776978 | 0.887755 |
48 | CMC | 0.773723 | 0.934066 |
49 | COA | 0.772727 | 0.955056 |
50 | IRC | 0.771429 | 0.966292 |
51 | KFV | 0.771429 | 0.896907 |
52 | 1GZ | 0.771429 | 0.945055 |
53 | COW | 0.771429 | 0.945055 |
54 | BYC | 0.771429 | 0.955556 |
55 | 30N | 0.768657 | 0.876289 |
56 | AMX | 0.768657 | 0.94382 |
57 | CAJ | 0.768116 | 0.955556 |
58 | BCA | 0.765957 | 0.945055 |
59 | DCR COA | 0.763889 | 0.966667 |
60 | MYR COA | 0.763889 | 0.966667 |
61 | DKA COA | 0.763889 | 0.966667 |
62 | DAO COA | 0.763889 | 0.966667 |
63 | EO3 COA | 0.763889 | 0.966667 |
64 | X90 COA | 0.763889 | 0.966667 |
65 | PLM COA | 0.763889 | 0.966667 |
66 | CMX | 0.762963 | 0.933333 |
67 | A1S | 0.76259 | 0.955556 |
68 | 2NE | 0.762238 | 0.934783 |
69 | 3CP | 0.758865 | 0.934066 |
70 | COF | 0.758865 | 0.913979 |
71 | ETB | 0.757576 | 0.922222 |
72 | HAX | 0.751825 | 0.913043 |
73 | 2CP | 0.751773 | 0.945055 |
74 | SCO | 0.75 | 0.933333 |
75 | 1CZ | 0.75 | 0.945055 |
76 | NMX | 0.748201 | 0.865979 |
77 | 2KQ | 0.746479 | 0.977778 |
78 | FAM | 0.744526 | 0.913043 |
79 | FCX | 0.744526 | 0.903226 |
80 | SCD | 0.742857 | 0.933333 |
81 | 4CA | 0.741259 | 0.923913 |
82 | CA6 | 0.741007 | 0.887755 |
83 | MCD | 0.741007 | 0.955556 |
84 | WCA | 0.734694 | 0.934783 |
85 | 6NA COA | 0.731034 | 0.966667 |
86 | 4KX | 0.72973 | 0.924731 |
87 | KGP | 0.728571 | 0.887755 |
88 | YZS | 0.728571 | 0.887755 |
89 | CIC | 0.726027 | 0.934066 |
90 | CCQ | 0.726027 | 0.935484 |
91 | 0FQ | 0.721088 | 0.934066 |
92 | 4CO | 0.721088 | 0.923913 |
93 | DAK | 0.72 | 0.924731 |
94 | J5H | 0.72 | 0.955556 |
95 | 01A | 0.716216 | 0.894737 |
96 | HFQ | 0.713333 | 0.913979 |
97 | KGJ | 0.713287 | 0.876289 |
98 | 1CV | 0.711409 | 0.955556 |
99 | CA8 | 0.710345 | 0.868687 |
100 | KGA | 0.710345 | 0.867347 |
101 | YE1 | 0.708333 | 0.923077 |
102 | SO5 | 0.708333 | 0.878788 |
103 | LCV | 0.708333 | 0.878788 |
104 | 1HA | 0.707792 | 0.934783 |
105 | UCA | 0.70625 | 0.977778 |
106 | NHQ | 0.705882 | 0.944444 |
107 | S0N | 0.702703 | 0.913043 |
108 | 01K | 0.692308 | 0.955556 |
109 | 7L1 | 0.687943 | 0.988764 |
110 | F8G | 0.687898 | 0.93617 |
111 | CA3 | 0.679245 | 0.934066 |
112 | COT | 0.677215 | 0.934066 |
113 | BUA COA | 0.673469 | 0.944444 |
114 | CA5 | 0.668712 | 0.894737 |
115 | CO7 | 0.662162 | 0.955556 |
116 | 93P | 0.654545 | 0.923913 |
117 | RMW | 0.648485 | 0.934783 |
118 | 93M | 0.64497 | 0.923913 |
119 | N9V | 0.636364 | 0.923913 |
120 | COD | 0.628571 | 0.94382 |
121 | HMG | 0.605096 | 0.923077 |
122 | 4BN | 0.6 | 0.93617 |
123 | 5TW | 0.6 | 0.93617 |
124 | JBT | 0.592391 | 0.916667 |
125 | OXT | 0.588889 | 0.93617 |
126 | COA FLC | 0.577181 | 0.922222 |
127 | BSJ | 0.551913 | 0.904255 |
128 | ASP ASP ASP ILE NH2 CMC | 0.534091 | 0.913043 |
129 | PAP | 0.51938 | 0.775281 |
130 | SFC | 0.5 | 0.956044 |
131 | RFC | 0.5 | 0.956044 |
132 | PPS | 0.485075 | 0.721649 |
133 | ACE SER ASP ALY THR NH2 COA | 0.484375 | 0.913043 |
134 | MET VAL ASN ALA CMC | 0.481675 | 0.913043 |
135 | A3P | 0.472868 | 0.764045 |
136 | 0WD | 0.470968 | 0.755319 |
137 | 1ZZ | 0.461538 | 0.866667 |
138 | ACE MET LEU GLY PRO NH2 COA | 0.45098 | 0.913043 |
139 | 5AD NJS | 0.445652 | 0.894737 |
140 | OMR | 0.444444 | 0.877778 |
141 | S2N | 0.43662 | 0.688889 |
142 | PTJ | 0.431507 | 0.833333 |
143 | MDE | 0.421875 | 0.978022 |
144 | PUA | 0.420732 | 0.784946 |
145 | A22 | 0.41958 | 0.777778 |
146 | MYR AMP | 0.418919 | 0.846154 |
147 | NA7 | 0.417808 | 0.820225 |
148 | 3AM | 0.415385 | 0.752809 |
149 | YLB | 0.414013 | 0.888889 |
150 | PAJ | 0.413793 | 0.844444 |
151 | ATR | 0.410072 | 0.764045 |
152 | 9BG | 0.409938 | 0.755319 |
153 | 5SV | 0.406897 | 0.853933 |
154 | WAQ | 0.405405 | 0.822222 |
155 | YLP | 0.403846 | 0.888889 |
156 | UBG | 0.403315 | 0.808511 |
157 | A2D | 0.402985 | 0.766667 |
158 | A2R | 0.402778 | 0.777778 |
159 | HQG | 0.402778 | 0.777778 |
160 | 3OD | 0.402685 | 0.788889 |
161 | 8LE | 0.401408 | 0.811111 |
162 | QA7 | 0.4 | 0.811111 |
163 | AGS | 0.4 | 0.791209 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 1sg4.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1sg4.bio2) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1sg4.bio2) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |