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Crystal structure of reactive center loop (rcl) cleaved angiotensinogen

Analyse Crystal structure of reactive center loop (rcl) cleaved angiotensinogen in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6I3I
Type
protein
Length
428 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Angiotensinogen
UniProt
P01019
Ligands
NAG
Pockets
3 · best druggability 0.52

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAngiotensinogenprotein42832% helix, 29% strandP01019

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A

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

Pockets

3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12260.520.7628empty
2840.390.7821empty
3700.360.7818empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6I3I · Crystal structure of reactive center loop (RCL) cleaved angiotensinogen · the same entry in another collection · chain A against A, TM-score 1.00
  • P01019 · AlphaFold monomer V2.0 prediction for angiotensinogen (P01019) · a predicted model of the same protein · chain A against A, TM-score 0.98

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