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Structure of the calcium-dependent lectin domain from a rat mannose-binding protein determined by mad phasing

Analyse Structure of the calcium-dependent lectin domain from a rat mannose-binding… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1MSB
Type
protein
Length
230 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mannose-binding protein-a
UniProt
P19999
Ligands
HO
Pockets
2 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 21% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMannose-binding protein-aprotein11521% helix, 33% strandP19999

Ligands and binding sites

  • HO · Holmium atom · metal · 4 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1700.330.7619empty
2510.270.7414empty

Interfaces

1 interface between chains.

  • A–B · 622 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1MSB · Structure of the calcium-dependent lectin domain from a rat mannose-binding protein… · the same entry in another collection · chain A against A, TM-score 1.00
  • P19999 · AlphaFold monomer V2.0 prediction for mannose-binding protein a (P19999) · a predicted model of the same protein · chain A against A, TM-score 0.97

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