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Crystal structure of extragenic suppressor protein suhb from bartonella henselae, via combined iodide sad molecular replacement

Analyse Crystal structure of extragenic suppressor protein suhb from bartonella… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3LUZ
Type
protein
Length
472 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Extragenic suppressor protein suhb
UniProt
Q6G1Z6
Ligands
MG, IOD
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AExtragenic suppressor protein suhbprotein23842% helix, 28% strandQ6G1Z6
BExtragenic suppressor protein suhbprotein23441% helix, 26% strandQ6G1Z6

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains A, B
  • IOD · Iodide ion · ion · 13 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12010.590.8138IOD
21810.460.7524empty
3720.290.7318empty

Interfaces

1 interface between chains.

  • A–B · 1215 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 3LUZ · Crystal structure of extragenic suppressor protein suhB from Bartonella henselae, via… · the same entry in another collection · chain A against A, TM-score 1.00

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