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Crystal structure of DNA-binding transcriptional dual regulator from escherichia COLI K-12

Analyse Crystal structure of DNA-binding transcriptional dual regulator from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MKL
Type
protein
Length
215 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hth-type transcriptional regulator gadx
UniProt
P37639
Pockets
1 · best druggability 0.24

Structure

x-ray diffraction · 2 distinct chains · 67% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHth-type transcriptional regulator gadxprotein10467% helix, 0% strandP37639
BHth-type transcriptional regulator gadxprotein11166% helix, 0% strandP37639

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1510.240.739empty

Interfaces

1 interface between chains.

  • A–B · 531 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 3MKL · Crystal structure of DNA-binding transcriptional dual regulator from Escherichia coli K-12 · the same entry in another collection · chain A against A, TM-score 1.00
  • P37639 · AlphaFold monomer V2.0 prediction for hth-type transcriptional regulator gadx (P37639) · a predicted model of the same protein · chain A against A, TM-score 0.98

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