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MolNFT v1 · #134716 · protein

Crystal structure of the human ubr-box domain from UBR1 in complex with monomethylated arginine peptide.

5TDC · E3 ubiquitin-protein ligase UBR1: “Crystal structure of the human ubr-box domain from UBR1 in complex with monomethylated arginine peptide.”. X-ray diffraction, 2 ligands (ZN, SO4). MolNFT v1 #134716 on GenesisL1: 3D structure…

PDB
5TDC
Type
protein
Length
148 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
E3 ubiquitin-protein ligase UBR1; Nmm-ile-phe-ser peptide
EC
6.3.2.-
UniProt
Q8IWV7
Ligands
ZN, SO4

Structure

x-ray diffraction · 4 distinct chains · 12% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AE3 ubiquitin-protein ligase UBR1 (EC 6.3.2.-)protein7013% helix, 23% strandQ8IWV7
CE3 ubiquitin-protein ligase UBR1 (EC 6.3.2.-)protein7113% helix, 21% strandQ8IWV7
BNmm-ile-phe-ser peptideprotein30% helix, 0% strand—
DNmm-ile-phe-ser peptideprotein40% helix, 0% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 6 copies · chains A, C
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B, C, D

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

Interfaces

3 interfaces between chains.

  • A–C · 471 Ų buried · 7 hydrogen bonds · protein-protein
  • C–D · 360 Ų buried · 7 hydrogen bonds · protein-protein
  • A–B · 336 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (nonstandard).

Compared structures

  • 5TDC · Crystal structure of the human UBR-box domain from UBR1 in complex with monomethylated… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8IWV7 · AlphaFold monomer V2.0 prediction for E3 ubiquitin-protein ligase UBR1 (Q8IWV7) · a predicted model of the same protein · chain A against A, TM-score 0.98

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