Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02131684
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.7 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.77 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.78 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.78 | |
TNB | S-(2,3,6-TRINITROPHENYL)CYSTEINE | A,B,C,D,E,F, G,H | 1AQX | 0.72 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.72 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.72 | |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.74 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.7 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.7 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.7 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.7 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.7 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.7 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.7 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.7 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.76 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
5BM | (2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrile | A | 3EQH | 0.74 | |
SBN | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE | A | 1JLQ | 0.75 |