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Crystal structure of putative transcriptional regulator of gntr family from bacteroides thetaiotaomicron

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

PDB
3IC7
Type
protein
Length
224 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative transcriptional regulator
UniProt
Q8A870
Pockets
3 · best druggability 0.44

Structure

x-ray diffraction · 2 distinct chains · 54% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative transcriptional regulatorprotein11355% helix, 10% strandQ8A870
BPutative transcriptional regulatorprotein11154% helix, 10% strandQ8A870

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1830.440.8013empty
21750.430.7430empty
3670.360.7713empty

Interfaces

1 interface between chains.

  • A–B · 136 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 3IC7 · Crystal Structure of Putative Transcriptional Regulator of GntR Family from Bacteroides… · the same entry in another collection · chain A against A, TM-score 1.00

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