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MolNFT v1 · #66481 · protein

Crystal structure of staphylococcus aureus protein sarz in sulfenic acid form

3HRM · Hth-type transcriptional regulator sarz: “Crystal structure of staphylococcus aureus protein sarz in sulfenic acid form”. X-ray diffraction, 3 pockets (best druggability 0.52). MolNFT v1 #66481 on GenesisL1: 3D structure, binding…

PDB
3HRM
Type
protein
Length
265 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hth-type transcriptional regulator sarz
UniProt
A6QJM6
Pockets
3 · best druggability 0.52

Structure

x-ray diffraction · 2 distinct chains · 71% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHth-type transcriptional regulator sarzprotein13172% helix, 5% strandA6QJM6
BHth-type transcriptional regulator sarzprotein13469% helix, 7% strandA6QJM6

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11380.520.8018empty
21320.510.7916empty
31530.450.7518empty

Interfaces

1 interface between chains.

  • A–B · 2599 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered, oxidation).

Compared structures

  • 3HRM · Crystal structure of Staphylococcus aureus protein SarZ in sulfenic acid form · the same entry in another collection · chain A against A, TM-score 1.00

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