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Crystal structure of the measles virus hemagglutinin bound to its cellular receptor slam (form I)

Analyse Crystal structure of the measles virus hemagglutinin bound to its cellular… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ALZ
Type
protein
Length
526 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hemagglutinin; CDW150
UniProt
E2RZS2, Q9GJT3
Ligands
NAG
Pockets
10 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHemagglutininprotein4176% helix, 47% strandE2RZS2
BCDW150protein1093% helix, 47% strandQ9GJT3

Ligands and binding sites

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

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14280.790.8750empty
21900.610.8330empty
33000.570.7739empty
4710.460.8221empty
51170.460.7823empty

Interfaces

1 interface between chains.

  • A–B · 1053 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 3ALZ · Crystal structure of the measles virus hemagglutinin bound to its cellular receptor SLAM… · the same entry in another collection · chain A against A, TM-score 1.00

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