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Crystal structure of a novel regulatory 40 kda mammary gland protein (mgp-40) secreted during involution

Analyse Crystal structure of a novel regulatory 40 kda mammary gland protein (mgp-40)… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1LJY
Type
protein
Length
361 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mgp-40
Ligands
NAG, NDG
Pockets
3 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMgp-40protein36136% helix, 23% strand—

Ligands and binding sites

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

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13480.570.7637empty
22290.550.7842empty
3560.310.7615empty

Modifications

Observed in the structure: 2 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 1LJY · Crystal Structure of a Novel Regulatory 40 kDa Mammary Gland Protein (MGP-40) secreted… · the same entry in another collection · chain A against A, TM-score 1.00

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