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Crystal structure of an orphan heme uptake protein (mhup) of ABC transporter from mycobacterium tuberculosis (form II)

Analyse Crystal structure of an orphan heme uptake protein (mhup) of ABC transporter… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7FHP
Type
protein
Length
584 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Probable periplasmic iron-transport lipoprotein
UniProt
L7N6B2
Ligands
SO4, SO3
Pockets
2 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProbable periplasmic iron-transport lipoproteinprotein29244% helix, 18% strandL7N6B2

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A
  • SO3 · Sulfite ion · ion · chains A
  • GOL · Glycerol · additive · 4 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18590.740.7865GOL
28470.710.7662empty

Interfaces

1 interface between chains.

  • A–B · 669 Ų buried · 15 hydrogen bonds · protein-protein

Compared structures

  • 7FHP · Crystal structure of an orphan heme uptake protein (MhuP) of ABC transporter from… · the same entry in another collection · chain A against A, TM-score 1.00

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