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MolNFT v1 · #159360 · protein

Crystal structure of the zn-bound domain-swapped dimer Q108K:T51D:A28C:L36C:F57H mutant of human cellular retinol binding protein II

6ON5 · Retinol-binding protein 2: “Crystal structure of the zn-bound domain-swapped dimer Q108K:T51D:A28C:L36C:F57H mutant of human cellular…”. X-ray diffraction, 1 ligand (ZN), 3 pockets (best druggability 0.76). MolNFT v1 #159360 on…

PDB
6ON5
Type
protein
Length
266 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Retinol-binding protein 2
UniProt
P50120
Ligands
ZN
Pockets
3 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 11% helix, 60% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRetinol-binding protein 2protein13311% helix, 60% strandP50120

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13120.760.8749empty
21320.700.9026empty
31270.550.8222ZN

Interfaces

1 interface between chains.

  • A–B · 3974 Ų buried · 83 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6ON5 · Crystal Structure of the Zn-bound Domain-Swapped Dimer Q108K:T51D:A28C:L36C:F57H Mutant… · the same entry in another collection · chain A against A, TM-score 1.00
  • P50120 · AlphaFold monomer V2.0 prediction for retinol-binding protein 2 (P50120) · a predicted model of the same protein · chain A against A, TM-score 0.57

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