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MolNFT v1 · #254734 · protein

AlphaFold monomer V2.0 prediction for 3-hydroxy-3-methylglutaryl- coenzyme a reductase (P13702)

P13702 · 3-hydroxy-3-methylglutaryl-coenzyme a reductase: “AlphaFold monomer V2.0 prediction for 3-hydroxy-3-methylglutaryl- coenzyme a reductase (P13702)”. 3 pockets (best druggability 0.70). MolNFT v1 #254734 on GenesisL1: 3D structure…

Accession
P13702
Type
protein
Length
428 residues
Chains
1
Collection
MolNFT v1 / AlphaFold
Contract
0xBf7491af3407816DFa88a5EA4c82e8A2B1D721eD
Owner
0x4171907A2b7c0ad532012140Dfcbb65629f05c34
Molecule
3-hydroxy-3-methylglutaryl-coenzyme a reductase
UniProt
P13702
Pockets
3 · best druggability 0.70

Structure

1 distinct chain · 50% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A3-hydroxy-3-methylglutaryl-coenzyme a reductaseprotein42850% helix, 19% strandP13702

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18050.700.7673empty
22650.580.7932empty
3630.290.7314empty

Compared structures

  • 1QAX · Ternary complex of pseudomonas mevalonii hmg-CoA reductase with hmg- CoA and NAD+ · an experimental structure of the same protein · chain A against A, TM-score 0.96
  • 8GDN · Structure of PmHMGR bound to mevalonate, CoA and NAD. · an experimental structure of the same protein · chain A against A, TM-score 0.95
  • 8VLQ · Structure of PmHMGR bound to mevalonate, CoA and NAD 5 minutes after reaction initiation… · an experimental structure of the same protein · chain A against A, TM-score 0.95
  • 4I4B · HMG-CoA Reductase from Pseudomonas mevalonii complexed with NAD and intermediate… · an experimental structure of the same protein · chain A against A, TM-score 0.94
  • 4I4B · Hmg-CoA reductase from pseudomonas mevalonii complexed with NAD and intermediate… · an experimental structure of the same protein · chain A against A, TM-score 0.94
  • 1QAY · Ternary complex of pseudomonas mevalonii hmg-CoA reductase with mevalonate and NAD+ · an experimental structure of the same protein · chain A against A, TM-score 0.89
  • 1QAY · Ternary complex of pseudomonas mevalonii hmg-CoA reductase with mevalonate and NAD+ · an experimental structure of the same protein · chain A against A, TM-score 0.89
  • 8SZ6 · PmHMGR bound to mevaldehyde and CoA · an experimental structure of the same protein · chain A against A, TM-score 0.88
  • 4I6A · 3-hydroxy-3-methylglutaryl (HMG) Coenzyme A reductase from Pseudomonas mevalonii… · an experimental structure of the same protein · chain A against A, TM-score 0.87
  • 4I6A · 3-hydroxy-3-methylglutaryl (hmg) coenzyme a reductase from pseudomonas mevalonii… · an experimental structure of the same protein · chain A against A, TM-score 0.87
  • 1R31 · HMG-CoA reductase from Pseudomonas mevalonii complexed with HMG-CoA · an experimental structure of the same protein · chain A against A, TM-score 0.87
  • 1R31 · Hmg-CoA reductase from pseudomonas mevalonii complexed with hmg-CoA · an experimental structure of the same protein · chain A against A, TM-score 0.87

Analyse

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