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The crystal structure of the transcriptional regulator, tetr family from cytophaga hutchinsonii

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

PDB
3EUP
Type
protein
Length
403 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transcriptional regulator, tetr family
UniProt
Q11R54
Ligands
SO4
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 75% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATranscriptional regulator, tetr familyprotein20375% helix, 1% strandQ11R54
BTranscriptional regulator, tetr familyprotein20075% helix, 1% strandQ11R54

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11690.780.9444empty
2860.510.8324empty
3940.500.8126empty
41660.490.7726empty
5530.300.7615empty

Interfaces

1 interface between chains.

  • A–B · 1837 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 3EUP · The crystal structure of the transcriptional regulator, TetR family from Cytophaga… · the same entry in another collection · chain A against A, TM-score 1.00

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