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Crystal structure of the rab GTPase SEC4P, the SEC2P gef domain, and phosphate complex

Analyse Crystal structure of the rab GTPase SEC4P, the SEC2P gef domain, and phosphate… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2EQB
Type
protein
Length
357 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RAS-related protein SEC4; Rab guanine nucleotide exchange factor SEC2
UniProt
P07560, P17065
Ligands
PO4
Pockets
1 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 56% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARAS-related protein SEC4protein17134% helix, 26% strandP07560
B, CRab guanine nucleotide exchange factor SEC2protein9397% helix, 0% strandP17065

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 2 copies · chains A, B, C

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1700.390.7922PO4

Interfaces

3 interfaces between chains.

  • B–C · 2496 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 873 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 471 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 2EQB · Crystal structure of the Rab GTPase Sec4p, the Sec2p GEF domain, and phosphate complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P07560 · AlphaFold monomer V2.0 prediction for RAS-related protein SEC4 (P07560) · a predicted model of the same protein · chain A against A, TM-score 0.89
  • P17065 · AlphaFold monomer V2.0 prediction for rab guanine nucleotide exchange factor SEC2 (P17065) · a predicted model of the same protein · chain B against A, TM-score 0.85

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