Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02864310
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 |
SLE | 2-(THIOMETHYLENE)-4-METHYLPENTANOIC ACID | A,B | 1ATL | 0.71 | |
IVA | ISOVALERIC ACID | A | 1YOO | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 4ER2 | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1APU | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1APW | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1APT | 0.77 | |
IVA | ISOVALERIC ACID | A | 2D5Y | 0.77 | |
IVA | ISOVALERIC ACID | A,I | 1GA4 | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1PPK | 0.77 | |
IVA | ISOVALERIC ACID | A,B,C,D | 1QS8 | 0.77 | |
IVA | ISOVALERIC ACID | A,B,C | 1NLU | 0.77 | |
IVA | ISOVALERIC ACID | A,B | 2RMP | 0.77 | |
IVA | ISOVALERIC ACID | A,B | 1KE1 | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1PPL | 0.77 | |
IVA | ISOVALERIC ACID | A,B,C,D,I,J | 1LYB | 0.77 | |
IVA | ISOVALERIC ACID | A | 2D64 | 0.77 | |
IVA | ISOVALERIC ACID | I | 2ER0 | 0.77 | |
IVA | ISOVALERIC ACID | I | 1QRP | 0.77 | |
IVA | ISOVALERIC ACID | E,I | 1APV | 0.77 | |
IVA | ISOVALERIC ACID | A,B | 1KDZ | 0.77 | |
IVA | ISOVALERIC ACID | A | 1UK9 | 0.77 | |
IVA | ISOVALERIC ACID | A,I | 1WKR | 0.77 | |
IVA | ISOVALERIC ACID | A,I | 3FNT | 0.77 | |
IVA | ISOVALERIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 3FV3 | 0.77 | |
IVA | ISOVALERIC ACID | I | 1PSO | 0.77 | |
IVA | ISOVALERIC ACID | I | 6APR | 0.77 | |
IVA | ISOVALERIC ACID | A | 2D63 | 0.77 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1YBA | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DS1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1H2L | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 1NX8 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BUC | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2RDN | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BIE | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,D | 1OIK | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 3DC1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDF | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 3D8C | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DRY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 2J9E | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1UNB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OIJ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFX | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1GQW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BKZ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2GP5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3GJB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GP4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2RDQ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 1HWY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2VDC | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BU0 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,F,G | 2Q8C | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1GY9 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OII | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2A1X | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1H2N | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 1NX4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2BRT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCV | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDI | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2YU1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDK | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1E5I | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1UOB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1OFE | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2ILM | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCU | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1AIB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1RXG | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1MZF | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1EA0 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DRT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2IUW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 3BN1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FD8 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2JJH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1IKA | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OS7 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1MDX | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1OFD | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2CJH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GP5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1CW4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BI3 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1BL5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1LLW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2ZE3 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GVG | 0.71 | |
SMB | 2-METHYLBUTANOIC ACID | A,B,C | 1YA8 | 0.77 | |
SMB | 2-METHYLBUTANOIC ACID | A | 1UKA | 0.77 | |
6NA | HEXANOIC ACID | A,B | 2IX4 | 0.71 | |
6NA | HEXANOIC ACID | A,B | 2IWZ | 0.71 | |
6NA | HEXANOIC ACID | A | 2IQ0 | 0.71 | |
LEA | LEVULINIC ACID | P | 1VWR | 0.77 | |
LEA | LEVULINIC ACID | M,P | 1VWJ | 0.77 | |
LEA | LEVULINIC ACID | A,B | 1W1Z | 0.77 | |
LEA | LEVULINIC ACID | A,B | 1B4K | 0.77 | |
LEA | LEVULINIC ACID | M,P | 1VWK | 0.77 | |
LEA | LEVULINIC ACID | P | 1VWQ | 0.77 | |
LEA | LEVULINIC ACID | A | 1UK8 | 0.77 | |
LEA | LEVULINIC ACID | M,P | 1VWL | 0.77 | |
LEA | LEVULINIC ACID | M,P | 1VWI | 0.77 | |
LEA | LEVULINIC ACID | A | 1B4E | 0.77 | |
3OC | (1R)-3-oxocyclohexanecarboxylic acid | A,B | 3DZL | 0.77 | |
SHF | LAEVULINIC ACID | A | 1YLV | 0.89 | |
SHF | LAEVULINIC ACID | A | 1H7N | 0.89 | |
TRC | TRICARBALLYLIC ACID | A | 6ACN | 0.8 | |
TRC | TRICARBALLYLIC ACID | A,B | 2PW0 | 0.8 | |
TRC | TRICARBALLYLIC ACID | A | 5ACN | 0.8 | |
MAH | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQA | 0.72 | |
MAH | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQ8 | 0.72 | |
LML | ISOBUTYL MALONIC ACID | A | 1BFW | 0.73 | |
DTG | DES-AMINO T-BUTYL GLYCINE | A,B,C,D | 2WPO | 0.7 | |
4AT | 5-OXOHEXANOIC ACID | A,B | 2EFY | 0.71 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 1QS0 | 0.84 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,C | 1UMD | 0.84 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A | 1DXY | 0.84 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 2HDK | 0.84 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A | 1HJF | 0.84 | |
OXS | 2-OXALOSUCCINIC ACID | A | 1IDC | 0.73 | |
HCT | (2R)-butane-1,2,4-tricarboxylic acid | A,B,C | 3DP8 | 0.73 | |
HCT | (2R)-butane-1,2,4-tricarboxylic acid | A,B,C | 3E3K | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 1I1M | 0.83 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 2EIY | 0.83 | |
4MV | 4-METHYL VALERIC ACID | A | 2ECO | 0.83 | |
4MV | 4-METHYL VALERIC ACID | A,C,D | 1UMC | 0.83 | |
4MV | 4-METHYL VALERIC ACID | A,B | 2COG | 0.83 | |
LAF | 5-FLUOROLEVULINIC ACID | A,B | 1GZG | 0.78 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1KTA | 0.78 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A | 1HJG | 0.78 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1SR9 | 0.78 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B,C,D,E | 1O68 | 0.78 | |
SIF | 3-TRIMETHYLSILYLSUCCINIC ACID | A,B | 1FUQ | 0.7 | |
2PP | 2-PROPYL-PENTANOIC ACID | P | 1DIT | 0.78 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | E,I | 6TMN | 0.7 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | I | 1DS2 | 0.7 | |
SHU | 4,6-DIOXOHEPTANOIC ACID | A | 1H7R | 0.72 |