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Crystal structure of MRECK(CC4) in fusion with engineered mbp at medium resolution

Analyse Crystal structure of MRECK(CC4) in fusion with engineered mbp at medium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6WBH
Type
protein
Length
431 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Maltodextrin-binding PROTEIN,REVERSION-inducing cysteine- rich protein with kazal motifs…
UniProt
A0A376KDN7, Q9Z0J1
Ligands
GLC, ZN, CL
Pockets
2 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMaltodextrin-binding PROTEIN,REVERSION-inducing cysteine- rich protein with kazal motifs fusionprotein43149% helix, 18% strandA0A376KDN7, Q9Z0J1

Ligands and binding sites

  • GLC · alpha-D-glucopyranose · sugar · 2 copies · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13380.710.8435GLC
26230.660.7667empty

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 6WBH · Crystal structure of mRECK(CC4) in fusion with engineered MBP at medium resolution · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9Z0J1 · AlphaFold monomer V2.0 prediction for reversion-inducing cysteine- rich protein with… · a predicted model of the same protein · chain A against A, TM-score 0.30

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