Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01738927
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 |
TNS | A,B,L | 2G2R | 0.71 | ||
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.72 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.73 | |
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.73 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.77 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.77 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.84 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.84 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.75 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.71 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.71 | |
NP1 | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.78 | |
HNT | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.71 | |
PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.71 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.75 | |
MGR | MALACHITE GREEN | A | 1Q8N | 0.75 | |
MGR | MALACHITE GREEN | A,B | 3BR0 | 0.75 | |
MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.75 | |
MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.75 | |
MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.75 | |
PNC | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.71 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.75 | |
TPM | 2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM | J,K,L | 1F3D | 0.76 | |
AAH | H | 1KEL | 0.7 | ||
AAH | B,H | 1FL6 | 0.7 | ||
UFO | 1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine | A,B,D | 3GQT | 0.7 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.75 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.73 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.73 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.73 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.73 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.73 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.73 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.73 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.73 |