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Solution structure of a semi-synthetic C5A receptor antagonist at pH 5.2, 303K, NMR, 20 structures

Analyse Solution structure of a semi-synthetic C5A receptor antagonist at pH 5.2, 303K… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1CFA
Type
protein
Length
75 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Complement 5A semi-synthetic antagonist; Synthetic N-terminal tail
UniProt
P01031

Structure

solution nmr · 2 distinct chains · 52% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AComplement 5A semi-synthetic antagonistprotein7155% helix, 0% strandP01031
BSynthetic N-terminal tailprotein40% helix, 0% strand—

Interfaces

1 interface between chains.

  • A–B · 280 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 4 disulfide, 1 d-amino (disulfide, D-amino acid).

Compared structures

  • 1CFA · Solution structure of a semi-synthetic C5A receptor antagonist at pH 5.2, 303K, NMR, 20… · the same entry in another collection · chain A against A, TM-score 1.00
  • P01031 · AlphaFold monomer V2.0 prediction for complement C5 (P01031) · a predicted model of the same protein · chain A against A, TM-score 0.55

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