Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03506867
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 |
IPM | 3-ISOPROPYLMALIC ACID | A,B | 1A05 | 0.71 | |
IPM | 3-ISOPROPYLMALIC ACID | A | 1HJ6 | 0.71 | |
RB3 | (1R)-3-{[(1R)-3-METHOXY-1-METHYL- 3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)- 3-HYDROXYBUTANOATE | A | 2D81 | 0.8 | |
DXX | METHYLMALONIC ACID | A | 1CWZ | 0.7 | |
DXX | METHYLMALONIC ACID | A,B,C,D,E,F | 1ON3 | 0.7 | |
DXX | METHYLMALONIC ACID | A | 1CW8 | 0.7 | |
VAD | DEAMINOHYDROXYVALINE | C | 1CWO | 0.82 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A | 2ECQ | 0.91 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A,B,C,D | 3EEW | 0.91 | |
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 | |
AAE | ACETOACETIC ACID | A,B,C,D | 3EEW | 0.7 | |
AAE | ACETOACETIC ACID | A | 1FCP | 0.7 | |
AAE | ACETOACETIC ACID | A | 1UJW | 0.7 | |
AAE | ACETOACETIC ACID | A,B | 1QCO | 0.7 | |
AAE | ACETOACETIC ACID | A,B,C,D,L | 1E3W | 0.7 | |
AAE | ACETOACETIC ACID | A,B | 1YSL | 0.7 | |
AAE | ACETOACETIC ACID | A | 2FCP | 0.7 | |
SMB | 2-METHYLBUTANOIC ACID | A,B,C | 1YA8 | 0.77 | |
SMB | 2-METHYLBUTANOIC ACID | A | 1UKA | 0.77 | |
KPL | KETOPANTOATE | A,B,C,D,E,F, G,H,I,J | 1M3U | 0.74 | |
BUQ | 4-HYDROXY-2-BUTANONE | A,B | 1D7J | 0.72 | |
MEV | (R)-MEVALONATE | A,B | 1QAY | 0.77 | |
MEV | (R)-MEVALONATE | A | 2HFU | 0.77 | |
MEV | (R)-MEVALONATE | A,B | 1R31 | 0.77 | |
3HG | 3-HYDROXYPENTANEDIOIC ACID | A,B,C,D,E,F | 2CW6 | 0.74 | |
DMV | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.76 | |
3PB | (3R)-3-(phosphonooxy)butanoic acid | A,B,C,D,E,F | 3FG8 | 0.74 | |
HIU | (2R)-3-HYDROXY-2-METHYLPROPANOIC ACID | A | 3BPT | 0.86 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | E,I | 6TMN | 0.74 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | I | 1DS2 | 0.74 | |
3OH | 3-HYDROXY-PROPANOIC ACID | A | 1M33 | 0.71 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1KTA | 0.74 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A | 1HJG | 0.74 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1SR9 | 0.74 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B,C,D,E | 1O68 | 0.74 | |
LML | ISOBUTYL MALONIC ACID | A | 1BFW | 0.73 | |
DTG | DES-AMINO T-BUTYL GLYCINE | A,B,C,D | 2WPO | 0.7 | |
GVM | (3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID | A,B | 2UW1 | 0.72 | |
THE | THREONATE ION | A | 1XIJ | 0.71 | |
PAF | PANTOATE | A,B | 2OFP | 0.73 | |
PAF | PANTOATE | A,B | 1N2E | 0.73 | |
PAF | PANTOATE | A,B | 1N2B | 0.73 | |
PAF | PANTOATE | A,B | 1N2J | 0.73 |