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Human insulin in complex with the analytical antibody hui-018 Fab

Analyse Human insulin in complex with the analytical antibody hui-018 Fab in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6Z7W
Type
protein
Length
1,902 residues
Chains
16
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mab 6H10 light chain; Hui-018 Fab heavy chain; Insulin
UniProt
P01308
Pockets
18 · best druggability 0.64

Structure

x-ray diffraction · 11 distinct chains · 9% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, E, GMab 6H10 light chainprotein2147% helix, 50% strand—
BHui-018 Fab heavy chainprotein2204% helix, 51% strand—
CMab 6H10 light chainprotein2135% helix, 49% strand—
DHui-018 Fab heavy chainprotein2134% helix, 53% strand—
FHui-018 Fab heavy chainprotein2166% helix, 53% strand—
HHui-018 Fab heavy chainprotein2195% helix, 52% strand—
IInsulinprotein1644% helix, 0% strandP01308
J, LInsulinprotein2458% helix, 13% strandP01308
K, M, OInsulinprotein2148% helix, 5% strandP01308
NInsulinprotein2658% helix, 12% strandP01308
PInsulinprotein2658% helix, 12% strandP01308

Pockets

18 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17050.640.7492empty
23710.550.7455empty
33300.540.7452empty
42890.520.7446empty
52860.520.7442empty

Interfaces

35 interfaces between chains.

  • E–F · 1887 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 1877 Ų buried · 14 hydrogen bonds · protein-protein
  • G–H · 1871 Ų buried · 17 hydrogen bonds · protein-protein
  • C–D · 1683 Ų buried · 14 hydrogen bonds · protein-protein
  • O–P · 632 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 29 disulfide (disulfide).

Compared structures

  • 6Z7W · Human insulin in complex with the analytical antibody HUI-018 Fab · the same entry in another collection · chain P against P, TM-score 1.00

Analyse

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