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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 15 families. | |||||
1 | 3NWQ | - | 2NC | C35 H68 N11 O8 | CCCC[C@@H].... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 15 families. | |||||
1 | 3NWQ | - | 2NC | C35 H68 N11 O8 | CCCC[C@@H].... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 2NC | 1 | 1 |
2 | KVI | 0.54386 | 0.981132 |
3 | PRO ALA THR ILE MET MET GLN ARG GLY ASN | 0.521739 | 0.928571 |
4 | THR ILE MET MET GLN ARG GLY | 0.462185 | 0.912281 |
5 | ILE GLN GLN SER ILE GLU ARG ILE | 0.438017 | 0.890909 |
6 | THR ARG ARG GLU THR GLN LEU | 0.432203 | 0.875 |
7 | KVS | 0.430769 | 0.912281 |
8 | ALA ARG THR ALY GLN THR ALA | 0.428571 | 0.909091 |
9 | UNX 2NC | 0.425197 | 0.87931 |
10 | ACE GLU ALA GLN THR ARG LEU | 0.422764 | 0.857143 |
11 | ARG ARG ARG GLU THR GLN VAL | 0.413793 | 0.857143 |
12 | ALA ASN SER ARG VAL GLN ASP SER ILE ILE | 0.412214 | 0.813559 |
13 | GLU ALA GLN THR ARG LEU | 0.408 | 0.872727 |
14 | ALA ARG THR M3L GLN THR ALA | 0.404959 | 0.809524 |
15 | ALA ARG THR M3L GLN THR ALA 2MR LYS | 0.404959 | 0.809524 |
16 | SAC ARG GLY THR GLN THR GLU | 0.404762 | 0.842105 |
17 | ACE GLN THR ALA ARG PRK SER THR | 0.403101 | 0.927273 |
This union binding pocket(no: 1) in the query (biounit: 3nwq.bio1) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1ULE | GLA GAL NAG | None |
2 | 1ONI | BEZ | None |
3 | 1H8P | PC | None |
4 | 3SJ0 | DXC | None |
5 | 4L8F | MTX | None |
6 | 4Y85 | 499 | None |
7 | 1SQL | GUN | None |
8 | 5C8W | PCG | None |
9 | 4TR1 | GSH | None |
10 | 5KEW | 6SB | None |
11 | 3WUD | GLC GAL | None |
12 | 3QRC | SCR | None |
13 | 1E4E | PHY | None |
14 | 3PNA | CMP | None |
15 | 1V3S | ATP | None |
16 | 5EZU | MYR | None |
17 | 3DUV | KDO | None |
18 | 1DCP | HBI | None |
19 | 6HT0 | GQ8 | None |
20 | 2Y7I | ARG | None |
21 | 2FPU | HSO | None |
22 | 5I8T | LAC | 2.0202 |
23 | 2I74 | MAN MAN MAN MAN | 2.0202 |
24 | 3SRV | S19 | 2.0202 |
25 | 4W9N | TCL | 2.0202 |
26 | 3QP4 | HL0 | 2.0202 |
27 | 5GLT | BGC GAL NAG GAL | 2.0202 |
28 | 4WOE | 3S5 | 3.0303 |
29 | 3P13 | RIP | 3.0303 |
30 | 3NCQ | ATP | 3.0303 |
31 | 1A78 | TDG | 3.0303 |
32 | 6GNF | GLC | 3.0303 |
33 | 4CZ1 | VNJ | 3.0303 |
34 | 2IOR | ADP | 3.0303 |
35 | 5TKL | G3H | 3.0303 |
36 | 5YBL | AKG | 3.0303 |
37 | 1BYG | STU | 3.0303 |
38 | 2W68 | SIA GAL BGC | 4.0404 |
39 | 3VKX | T3 | 4.0404 |
40 | 5T52 | NGA | 4.0404 |
41 | 2GSU | AMP | 4.0404 |
42 | 2YKL | NLD | 4.0404 |
43 | 4M26 | AKG | 4.0404 |
44 | 5T52 | A2G | 4.0404 |
45 | 5HCT | 61P | 5.05051 |
46 | 5W0N | UPU | 5.05051 |
47 | 1QS8 | IVA VAL VAL STA ALA STA | 5.05051 |
48 | 5YIC | 8VO | 5.05051 |
49 | 3ZXE | PGZ | 5.05051 |
50 | 4FL0 | PLP | 5.05051 |
51 | 4PU6 | ASP | 5.05051 |
52 | 2O1V | ADP | 5.05051 |
53 | 5W3Y | ACO | 5.05051 |
54 | 5IHE | D5M | 5.05051 |
55 | 1UP7 | G6P | 5.05051 |
56 | 1SMR | PIV HIS PRO PHE HIS LPL TYR TYR SER | 5.67164 |
57 | 1J71 | THR ILE THR SER | 6.06061 |
58 | 1IZE | IVA VAL VAL STA ALA STA | 6.06061 |
59 | 4XZ9 | G3P | 6.06061 |
60 | 2EFX | NFA | 6.06061 |
61 | 2VEG | PMM | 6.06061 |
62 | 1OFZ | FUL | 6.06061 |
63 | 2HKA | C3S | 6.06061 |
64 | 5L77 | GUX | 6.06061 |
65 | 5XLS | URA | 6.06061 |
66 | 1QRP | HH0 | 7.07071 |
67 | 3D91 | REM | 7.07071 |
68 | 1LYB | IVA VAL VAL STA ALA STA | 7.07071 |
69 | 6EOM | ALA LYS | 7.07071 |
70 | 3OYW | TDG | 7.07071 |
71 | 4Y24 | TD2 | 7.07071 |
72 | 3SHR | CMP | 7.07071 |
73 | 2WD7 | VGD | 7.07071 |
74 | 2WW4 | ADP | 7.07071 |
75 | 3B8I | OXL | 7.07071 |
76 | 2AK3 | AMP | 7.07071 |
77 | 3OCP | CMP | 7.07071 |
78 | 3MA0 | XYP | 7.07071 |
79 | 2P4S | DIH | 7.07071 |
80 | 1CZI | PRO PHI SMC NOR | 8.08081 |
81 | 1WKR | IVA VAL VAL STA ALA STA | 8.08081 |
82 | 4FCW | ADP | 8.08081 |
83 | 5Z7B | VNL | 8.08081 |
84 | 3WIR | BGC | 8.08081 |
85 | 2IMW | DDS | 8.08081 |
86 | 6EGU | 43Y | 8.08081 |
87 | 4BWL | MN9 | 8.08081 |
88 | 1GPM | CIT | 8.08081 |
89 | 4TQK | NAG | 8.08081 |
90 | 2BMB | PMM | 8.08081 |
91 | 2O2C | G6Q | 8.08081 |
92 | 6EJ2 | B7E | 9.09091 |
93 | 6HQD | SRT | 9.09091 |
94 | 3QVI | K95 | 9.09091 |
95 | 1P0Z | FLC | 9.09091 |
96 | 4ER2 | IVA VAL VAL STA ALA STA | 9.09091 |
97 | 4FHT | DHB | 9.09091 |
98 | 2BJU | IH4 | 9.09091 |
99 | 5N53 | 8NB | 9.09091 |
100 | 2QK4 | ATP | 9.09091 |
101 | 1UZ4 | IFL | 9.09091 |
102 | 4GID | 0GH | 9.09091 |
103 | 6B9T | 2HE | 9.09091 |
104 | 5LXT | GTP | 9.09091 |
105 | 5YZ2 | AMP | 9.09091 |
106 | 5CKW | ANP | 9.09091 |
107 | 5JDA | AMP | 9.09091 |
108 | 3ZKN | WZV | 10.101 |
109 | 4ZL4 | 4PK | 10.101 |
110 | 3ZLQ | 6T9 | 10.101 |
111 | 3ZKI | WZV | 10.101 |
112 | 5TE1 | 7A2 | 10.101 |
113 | 4USF | 6UI | 10.101 |
114 | 5OPJ | AHR | 10.101 |
115 | 1GPJ | CIT | 10.101 |
116 | 2H6T | IVA VAL VAL STA ALA STA | 11.1111 |
117 | 3FV3 | IVA VAL VAL STA ALA STA | 11.1111 |
118 | 2Y7P | SAL | 11.1111 |
119 | 5OKT | 9XK | 11.1111 |
120 | 6F92 | MVL | 11.1111 |
121 | 5K8P | 6R8 | 11.1111 |
122 | 5D85 | FLC | 11.1111 |
123 | 5VX9 | FUC GAL NAG GAL BGC | 11.8012 |
124 | 1FQ5 | 0GM | 12.1212 |
125 | 4UP4 | GAL NAG | 12.1212 |
126 | 5IFK | HPA | 12.1212 |
127 | 2W9S | TOP | 12.1212 |
128 | 1W0O | SIA | 13.1313 |
129 | 2X5D | PLP | 13.1313 |
130 | 3NB0 | G6P | 13.1313 |
131 | 3B99 | U51 | 13.1313 |
132 | 3OF1 | CMP | 13.1313 |
133 | 3WGC | PLG | 13.1313 |
134 | 2W8Q | SIN | 13.1313 |
135 | 3LKF | PC | 14.1414 |
136 | 1KOJ | PAN | 14.1414 |
137 | 3EMY | IVA VAL VAL STA ALA STA | 15.1515 |
138 | 3O9L | LPN | 15.1515 |
139 | 5YV5 | ADP | 15.1515 |
140 | 1VBO | MAN | 15.1515 |
141 | 1TKU | 5RP | 17.1717 |
142 | 5XSS | XYP | 18.1818 |
143 | 4G2R | H1L | 18.1818 |
144 | 3GCM | 5GP | 18.1818 |
145 | 3WSJ | MK1 | 20.202 |
146 | 1SLT | NDG GAL | 20.202 |
147 | 5VE5 | GSH | 20.202 |
148 | 2QZX | IVA VAL VAL STA ALA STA | 21.2121 |
149 | 1Y0L | HAN | 24.2424 |
150 | 1ZAP | A70 | 30.303 |
151 | 1Y0Y | L2O VAL VAL ASP | 34.3434 |
152 | 3SM2 | 478 | 46.4646 |
153 | 1BAI | 0Q4 | 48.4848 |