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MolNFT v1 · #169961 · protein

Crystal structure of human VPS29 complexed with rapid-derived cyclic peptide rt-L2

6XSA · Vacuolar protein sorting-associated protein 29: “Crystal structure of human VPS29 complexed with rapid-derived cyclic peptide rt-L2”. X-ray diffraction, 2 ligands (48V, SO4). MolNFT v1 #169961 on GenesisL1: 3D structure, binding…

PDB
6XSA
Type
protein
Length
198 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vacuolar protein sorting-associated protein 29…
UniProt
Q9UBQ0
Ligands
48V, SO4

Structure

x-ray diffraction · 2 distinct chains · 14% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVacuolar protein sorting-associated protein 29protein18315% helix, 38% strandQ9UBQ0
B48V-tyr-leu-pro-thr-ile-thr-gly-val-gly-his-leu-TRP-his- pro-leuprotein150% helix, 33% strand—

Ligands and binding sites

  • 48V · {[(2R)-2,3-diamino-3-oxopropyl]sulfanyl}acetic acid · ligand · chains B
  • SO4 · Sulfate ion · ion · chains A, B

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

Interfaces

1 interface between chains.

  • A–B · 645 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (covalent ligand).

Compared structures

  • 6XSA · Crystal structure of human Vps29 complexed with RaPID-derived cyclic peptide RT-L2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UBQ0 · AlphaFold monomer V2.0 prediction for vacuolar protein sorting- associated protein 29… · a predicted model of the same protein · chain A against A, TM-score 0.99

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