Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03545117
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 |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.73 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.73 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.73 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.73 | |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQP | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.85 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.85 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.74 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.74 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.74 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.74 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.74 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.74 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.74 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.73 | |
CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.73 | |
CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.73 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.73 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.71 | |
BCS | BENZYLCYSTEINE | A | 1EH8 | 0.71 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.76 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.77 | |
BIP | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.7 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.72 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.72 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.72 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.71 | |
295 | (2S,3S)-3-(4-fluorophenyl)-2,3- dihydroxypropanoic acid | A,B | 2RJR | 0.77 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.71 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.71 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.72 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.76 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.7 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.7 | |
BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.7 | |
CGT | CARBA-GLUCOTROPAEOLIN | M | 1W9B | 0.72 | |
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.73 |