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MolNFT v1 · #19029 · protein

Structure of the integrin ALPHA2BETA1 binding collagen peptide

1Q7D · Collagen alfa 1(I) chain peptide gpogpogfogergpogpogpo: “Structure of the integrin ALPHA2BETA1 binding collagen peptide”. X-ray diffraction, 2 ligands (ACE, NH2). MolNFT v1 #19029 on GenesisL1: 3D structure, binding sites and…

PDB
1Q7D
Type
protein
Length
62 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Collagen alfa 1(I) chain peptide gpogpogfogergpogpogpo
UniProt
P02452
Ligands
ACE, NH2

Structure

x-ray diffraction · 2 distinct chains · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCollagen alfa 1(I) chain peptide gpogpogfogergpogpogpoprotein210% helix, 0% strandP02452
CCollagen alfa 1(I) chain peptide gpogpogfogergpogpogpoprotein200% helix, 0% strandP02452

Ligands and binding sites

  • ACE · Acetyl group · ligand · 3 copies · chains A, B, C
  • NH2 · Amino group · ion · 2 copies · chains A, B, C

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

Interfaces

3 interfaces between chains.

  • B–C · 713 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 690 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 614 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 17 modified, 3 covalent (hydroxylation, covalent ligand).

Compared structures

  • 1Q7D · Structure of the integrin alpha2beta1 binding collagen peptide · the same entry in another collection · chain A against A, TM-score 1.00
  • P02452 · AlphaFold monomer V2.0 prediction for collagen alpha-1(I) chain (P02452) · a predicted model of the same protein · chain C against A, TM-score 0.29

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