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Integrin ALPHAM/BETA2 ectodomain

Analyse Integrin ALPHAM/BETA2 ectodomain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7USM
Type
protein
Length
1,521 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Integrin alpha-M; Integrin beta
UniProt
P11215, A0A494C0X7
Ligands
NAG, CA
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 2 distinct chains · 11% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIntegrin alpha-Mprotein8484% helix, 48% strandP11215
BIntegrin betaprotein67321% helix, 28% strandA0A494C0X7

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 11 copies · chains A, B
  • CA · Calcium ion · metal · 4 copies · chains A, B

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

Pockets

20 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111880.820.8391empty
27070.740.8055empty
33870.630.7847empty
42440.560.7831empty
53020.550.7631empty

Interfaces

1 interface between chains.

  • A–B · 2756 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 28 disulfide, 10 glycan (disulfide, N-glycosylation).

Compared structures

  • 7USM · Integrin alphaM/beta2 ectodomain · the same entry in another collection · chain A against A, TM-score 1.00
  • P11215 · AlphaFold monomer V2.0 prediction for integrin alpha-M (P11215) · a predicted model of the same protein · chain A against A, TM-score 0.64

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