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MolNFT v1 · #41210 · protein

Structure of the arsenated de novo designed peptide coil ser L9C

2JGO: “Structure of the arsenated de novo designed peptide coil ser L9C”. X-ray diffraction, 4 ligands (ACE, ZN, ARS). MolNFT v1 #41210 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2JGO
Type
protein
Length
87 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Coil ser L9C
Ligands
ACE, ZN, ARS, NH2

Structure

x-ray diffraction · 1 distinct chain · 90% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CCoil ser L9Cprotein2990% helix, 0% strand—

Ligands and binding sites

  • ACE · Acetyl group · ligand · 3 copies · chains A, B, C
  • ZN · Zinc ion · metal · 4 copies · chains A, B
  • ARS · Arsenic · metal · chains A, B, C
  • NH2 · Amino group · ion · 3 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.

  • A–B · 636 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 605 Ų buried · 1 hydrogen bond · protein-protein
  • A–C · 591 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 covalent (covalent ligand).

Compared structures

  • 2JGO · Structure of the arsenated de novo designed peptide Coil Ser L9C · the same entry in another collection · chain A against A, TM-score 1.00

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