Attributes
UniProt ID
Protein Name
Cyclic GMP-AMP synthase
Ligand Name
N-[4-({[(6S)-2-amino-5-methyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-gamma-glutamyl-L-glutamic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VNEFZDDORGCJSD-JYJNAYRXSA-N
SMILES
CN1C(CNC2=C1C(=O)N=C(N2)N)CNc3ccc(cc3)C(=O)NC(CCC(=O)NC(CCC(=O)O)C(=O)O)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4U03
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Color Legend
Unassigned regionsLigand / hetero atomse4u03A1e4u03A2e4u03B1e4u03B2
ECOD domains from experimental PDB structures interacting with ligand TLL
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q9KVG7 | n/a | TLL | 4u03 | e4u03A2 | A:3-216,A:238-275 |
| Q9KVG7 | n/a | TLL | 4u03 | e4u03B1 | B:276-411 |
| Q9KVG7 | n/a | TLL | 4u03 | e4u03B2 | B:2-211,B:237-275 |
| Q9KVG7 | n/a | TLL | 4u0m | e4u0mA2 | A:3-215,A:238-275 |
| Q9KVG7 | n/a | TLL | 4u0m | e4u0mB1 | B:276-411 |
| Q9KVG7 | n/a | TLL | 4u0n | e4u0nA1 | A:3-233 |
| Q9KVG7 | n/a | TLL | 4u0n | e4u0nB1 | B:3-233 |