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Matc (RPA3494) from rhodopseudomonas palustris with bound malate

Analyse Matc (RPA3494) from rhodopseudomonas palustris with bound malate in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6HKE
Type
protein
Length
885 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Possible tctc subunit of the tripartite tricarboxylate TRANSPORT(TTT) family
UniProt
Q6N446
Ligands
MLT, LMR
Pockets
7 · best druggability 0.70

Structure

x-ray diffraction · 3 distinct chains · 43% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APossible tctc subunit of the tripartite tricarboxylate TRANSPORT(TTT) familyprotein29442% helix, 21% strandQ6N446
BPossible tctc subunit of the tripartite tricarboxylate TRANSPORT(TTT) familyprotein29643% helix, 21% strandQ6N446
CPossible tctc subunit of the tripartite tricarboxylate TRANSPORT(TTT) familyprotein29543% helix, 21% strandQ6N446

Ligands and binding sites

  • MLT · D-malate · ligand · 3 copies · chains A, B, C
  • LMR · (2S)-2-hydroxybutanedioic acid · ligand · 3 copies · chains A, B, C

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

Pockets

7 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14020.700.8258empty
24780.610.7550empty
3690.510.8518empty
41020.510.8223empty
5900.470.8124empty

Interfaces

2 interfaces between chains.

  • A–B · 792 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 460 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 6HKE · MatC (Rpa3494) from Rhodopseudomonas palustris with bound malate · the same entry in another collection · chain A against A, TM-score 1.00

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