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Crystal structure of xrbj

Analyse Crystal structure of xrbj in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JMG
Type
protein
Length
530 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dnaj homolog subfamily C member 27-a
UniProt
Q7ZYF1
Ligands
GTP, MG
Pockets
5 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADnaj homolog subfamily C member 27-aprotein26746% helix, 18% strandQ7ZYF1
BDnaj homolog subfamily C member 27-aprotein26345% helix, 18% strandQ7ZYF1

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110560.830.8480empty
22760.620.8040GTP, MG
31970.570.8039GTP, MG
4790.390.7816empty
5750.370.7712empty

Interfaces

1 interface between chains.

  • A–B · 1399 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 6JMG · Crystal structure of xRbj · the same entry in another collection · chain A against A, TM-score 1.00
  • Q7ZYF1 · AlphaFold monomer V2.0 prediction for dnaj homolog subfamily C member 27-a (Q7ZYF1) · a predicted model of the same protein · chain B against A, TM-score 0.91

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