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Myxococcus xanthus mgla in GDP bound conformation

Analyse Myxococcus xanthus mgla in GDP bound conformation in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5YMX
Type
protein
Length
397 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mutual gliding-motility protein mgla
EC
3.6.5.2
UniProt
Q1DB04
Ligands
GDP
Pockets
5 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMutual gliding-motility protein mgla (EC 3.6.5.2)protein20236% helix, 27% strandQ1DB04
BMutual gliding-motility protein mgla (EC 3.6.5.2)protein19535% helix, 27% strandQ1DB04

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · 2 copies · chains A, B
  • IMD · Imidazole · additive · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · chains A

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
13170.590.7842empty
22470.550.7725empty
3950.390.7618empty
4700.330.7517EDO
5620.330.7612empty

Interfaces

1 interface between chains.

  • A–B · 382 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5YMX · Myxococcus xanthus MglA in GDP bound conformation · the same entry in another collection · chain A against A, TM-score 1.00
  • Q1DB04 · AlphaFold monomer V2.0 prediction for mutual gliding-motility protein mgla (Q1DB04) · a predicted model of the same protein · chain B against A, TM-score 0.92

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