MolNFT v1 · #191415 · protein
Crystal structure of human KRAS G12C covalently bound with araxes WO2020/028706A1 compound I-1
8DNI: “Crystal structure of human KRAS G12C covalently bound with araxes WO2020/028706A1 compound I-1”. X-ray diffraction, 3 ligands (GDP, U4L, MG). MolNFT v1 #191415 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 8DNI
- Type
- protein
- Length
- 170 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P01116
- Ligands
- GDP, U4L, MG
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 170 | — | P01116 |
Ligands and binding sites
- GDP · Guanosine-5'-diphosphate · ligand · chains A
- U4L · (4P)-4-(5-methyl-1H-indazol-4-yl)-6-(2-propanoyl-2,6-diazaspiro[3.4]octan-6-yl)-2-(pyrrolidin-1-yl) pyrimidine-5-carbonitrile · ligand · chains A
- MG · Magnesium ion · metal · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 8DNI · Crystal structure of human KRAS G12C covalently bound with Araxes WO2020/028706A1… · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P01116
- Elsewhere: RCSB PDB 8DNI · PDBe 8DNI · UniProt P01116
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