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Crystal structure of ARGININE/ORNITHINE transport system ATPase from mycobacterium tuberculosis bound to GDP (a RAS-like GTPase superfamily protein)

Analyse Crystal structure of ARGININE/ORNITHINE transport system ATPase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MD0
Type
protein
Length
301 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ARGININE/ORNITHINE transport system ATPase
UniProt
P63577
Ligands
GDP, UNX
Pockets
4 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 58% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AARGININE/ORNITHINE transport system ATPaseprotein30158% helix, 12% strandP63577

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • UNX · Unknown atom or ion · ion · 4 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11870.550.7924empty
21660.450.7521empty
3790.330.7515empty
4670.300.7413empty

Compared structures

  • 3MD0 · Crystal structure of arginine/ornithine transport system ATPase from Mycobacterium… · the same entry in another collection · chain A against A, TM-score 1.00

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