MolNFT v1 · #332820 · protein
AlphaFold monomer V2.0 prediction for GTPase KRAS (P01116)
P01116: “AlphaFold monomer V2.0 prediction for GTPase KRAS (P01116)”. 2 pockets (best druggability 0.54). MolNFT v1 #332820 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- Accession
- P01116
- Type
- protein
- Length
- 189 residues
- Chains
- 1
- Collection
- MolNFT v1 / AlphaFold
- Contract
- 0xBf7491af3407816DFa88a5EA4c82e8A2B1D721eD
- Owner
- 0xc08C993Bfd6bbC570C5284aE6586e6De38BDACc6
- Molecule
- GTPase KRAS
- UniProt
- P01116
- Pockets
- 2 · best druggability 0.54
Structure
1 distinct chain · 40% helix, 25% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | GTPase KRAS | protein | 189 | 40% helix, 25% strand | P01116 |
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 166 | 0.54 | 0.80 | 33 | empty |
| 2 | 60 | 0.35 | 0.78 | 14 | empty |
Compared structures
- 4DSO · Small-molecule ligands bind to a distinct pocket in Ras and inhibit SOS-mediated… · an experimental structure of the same protein · chain A against A, TM-score 0.91
- 4DSN · Small-molecule ligands bind to a distinct pocket in Ras and inhibit SOS-mediated… · an experimental structure of the same protein · chain A against A, TM-score 0.91
- 4DST · Small-molecule ligands bind to a distinct pocket in Ras and inhibit SOS-mediated… · an experimental structure of the same protein · chain A against A, TM-score 0.91
- 7RSE · NMR-driven structure of the KRAS4B-G12D alpha-beta" dimer on a lipid bilayer nanodisc" · an experimental structure of the same protein · chain A against A, TM-score 0.90
- 2MSE · NMR data-driven model of GTPase KRas-GNP:ARafRBD complex tethered to a lipid-bilayer… · an experimental structure of the same protein · chain A against B, TM-score 0.90
- 6W4E · NMR-driven structure of KRAS4B-GTP homodimer on a lipid bilayer nanodisc · an experimental structure of the same protein · chain A against C, TM-score 0.90
- 7RSC · NMR-driven structure of the KRAS4B-G12D alpha-alpha" dimer on a lipid bilayer nanodisc" · an experimental structure of the same protein · chain A against B, TM-score 0.89
- 6GOF · KRAS full length G12D GPPNHP · an experimental structure of the same protein · chain A against A, TM-score 0.89
- 6GOD · KRAS full length wild-type GPPNHP · an experimental structure of the same protein · chain A against A, TM-score 0.89
- 8T74 · Crystal structure of KRAS4a (GMPPNP) in complex with RAF1 (RBD) · an experimental structure of the same protein · chain A against A, TM-score 0.89
- 5OCG · Discovery of small molecules binding to KRAS via high affinity antibody fragment… · an experimental structure of the same protein · chain A against A, TM-score 0.89
- 7SCW · KRAS full length wild-type in complex with RGL1 Ras association domain · an experimental structure of the same protein · chain A against A, TM-score 0.89
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: UniProt P01116 · AlphaFold DB P01116
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