UniProt P79800
GTPase KRas (P79800)
GTPase KRas (UniProt P79800), EC 3.6.5.2: 1 experimental structure and 1 predicted model on GenesisL1, 4 ligands bound, 6 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- P79800
- Protein
- GTPase KRas
- EC
- 3.6.5.2
- Experimental structures
- 1
- Predicted models
- 1
- Ligands
- 4
- Pockets
- 6 · 2 records with a druggable one
Structures
2 records of P79800 in the MolNFT archive: 1 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 9BGH | Crystal structure of KRAS G12D in a transition state mimetic complex with CYPA and RMC-7977 | x-ray diffraction | A, C | ZNI, GDP, MG, AF3 | 5 (best 0.81) |
| P79800 | AlphaFold monomer V2.0 prediction for GTPase KRAS (P79800) | predicted | A | — | 1 (best 0.53) |
Ligands
- AF3 · Aluminum fluoride · in 1 record
- GDP · Guanosine-5'-diphosphate · in 1 record
- MG · Magnesium ion · in 1 record
- ZNI · (1R,5S,6r)-N-[(1P,7S,9S,13S,20M)-20-{5-(4-cyclopropylpiperazin-1-yl)-2-[(1S)-1-methoxyethyl]pyridin-3-yl}-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.1~2,5~.1~9,13~.0~22,26~]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide · in 1 record
Experiment against prediction
- 9BGH chain A against the predicted model P79800: TM-score 0.98, RMSD 0.55 Å
- 9BGH chain C against the predicted model P79800: TM-score 0.98, RMSD 0.65 Å
Elsewhere
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