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The multi-drug binding transcriptional repressor cgmr (CGL2612 protein) from C.GLUTAMICUM

Analyse The multi-drug binding transcriptional repressor cgmr (CGL2612 protein) from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2ZOY
Type
protein
Length
347 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcriptional regulator
UniProt
Q8NMG3
Pockets
6 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscriptional regulatorprotein17573% helix, 0% strandQ8NMG3
BTranscriptional regulatorprotein17276% helix, 0% strandQ8NMG3

Ligands and binding sites

  • GOL · Glycerol · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11770.630.8433GOL
21190.570.8416empty
3820.530.8520GOL
4690.340.7614empty
5550.330.7812empty

Interfaces

1 interface between chains.

  • A–B · 1947 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 2ZOY · The multi-drug binding transcriptional repressor CgmR (CGL2612 protein) from C.glutamicum · the same entry in another collection · chain A against A, TM-score 1.00

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