Attributes
UniProt ID
Protein Name
1-deoxy-D-xylulose-5-phosphate synthase
Ligand Name
2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]phenyl}ethanol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CLAXVJRRXGSGJP-UHFFFAOYSA-N
SMILES
Cc1ncc(c(n1)N)Cc2cccc(c2)CCO
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 8A4D
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Color Legend
Unassigned regionsLigand / hetero atomse8a4dA1e8a4dA2e8a4dA3e8a4dB1e8a4dB2e8a4dB3e8a4dC1e8a4dC2e8a4dC3e8a4dD1e8a4dD2e8a4dD3e8a4dE1e8a4dE2e8a4dE3e8a4dF1e8a4dF2e8a4dF3
ECOD domains from experimental PDB structures interacting with ligand 26G
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| B7V7R4 | n/a | 26G | 8a4d | e8a4dA2 | A:319-490 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dA3 | A:32-217,A:241-293,A:295-318 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dB2 | B:34-217,B:242-293,B:295-318 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dB3 | B:319-490 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dC1 | C:319-490 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dC3 | C:32-217,C:241-293,C:295-318 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dD1 | D:33-217,D:241-293 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dD3 | D:319-490 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dE1 | E:29-217,E:241-293 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dE2 | E:319-490 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dF2 | F:32-217,F:241-293,F:295-318 |
| B7V7R4 | n/a | 26G | 8a4d | e8a4dF3 | F:319-490 |