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Crystal structure of the response regulatory protein prra from mycobacterium tuberculosis

Analyse Crystal structure of the response regulatory protein prra from mycobacterium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1YS6
Type
protein
Length
452 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcriptional regulatory protein prra
UniProt
Q10531
Ligands
CA
Pockets
1 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscriptional regulatory protein prraprotein22540% helix, 22% strandQ10531
BTranscriptional regulatory protein prraprotein22740% helix, 21% strandQ10531

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111250.740.7784CA

Interfaces

1 interface between chains.

  • A–B · 507 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 1YS6 · Crystal structure of the response regulatory protein PrrA from Mycobacterium Tuberculosis · the same entry in another collection · chain A against A, TM-score 1.00

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