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MolNFT v1 · #39634 · protein

X-ray crystal structure of magi-1 PDZ1 bound to the C- terminal peptide of HPV18 E6

2I04 · Membrane-associated guanylate kinase, ww and PDZ…: “X-ray crystal structure of magi-1 PDZ1 bound to the C- terminal peptide of HPV18 E6”. X-ray diffraction, 1 ligand (SO4). MolNFT v1 #39634 on GenesisL1: 3D structure, binding sites…

PDB
2I04
Type
protein
Length
182 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Membrane-associated guanylate kinase, ww and PDZ domain-containing protein 1; Peptide E6
UniProt
Q6RHR9, P06463
Ligands
SO4

Structure

x-ray diffraction · 3 distinct chains · 14% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMembrane-associated guanylate kinase, ww and PDZ domain-containing protein 1protein8516% helix, 40% strandQ6RHR9
CPeptide E6protein50% helix, 40% strandP06463
DPeptide E6protein70% helix, 43% strandP06463

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Interfaces

4 interfaces between chains.

  • A–B · 618 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 525 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 473 Ų buried · 13 hydrogen bonds · protein-protein
  • A–D · 37 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2I04 · X-ray crystal structure of MAGI-1 PDZ1 bound to the C-terminal peptide of HPV18 E6 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6RHR9 · AlphaFold monomer V2.0 prediction for membrane-associated guanylate kinase, ww and PDZ… · a predicted model of the same protein · chain A against A, TM-score 0.97

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