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MolNFT v2 · #105623 · protein

An engineered Axl 'decoy receptor' effectively silences the Gas6-Axl signaling axis

4RA0 · Growth arrest-specific protein 6: “An engineered Axl 'decoy receptor' effectively silences the Gas6-Axl signaling axis”. X-ray diffraction at 3.07, 5 ligands (NAG, CA, NI), 16 pockets (best druggability 0.60). MolNFT v2 #105623 on…

PDB
4RA0
Type
protein
Length
1,145 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.07
Source
Homo sapiens
Molecule
Growth arrest-specific protein 6; Tyrosine-protein kinase receptor UFO
EC
2.7.10.1
UniProt
P30530
Ligands
NAG, CA, NI, SO4, CL
Pockets
16 · best druggability 0.60

Structure

x-ray diffraction · resolution 3.07 · 3 distinct chains · 7% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGrowth arrest-specific protein 6protein3868% helix, 43% strand—
BGrowth arrest-specific protein 6protein3778% helix, 45% strand—
C, DTyrosine-protein kinase receptor UFO (EC 2.7.10.1)protein1912% helix, 54% strandP30530

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A, C, B, D
  • CA · Calcium ion · metal · 2 copies · chains A, B
  • NI · Nickel (II) ion · metal · 2 copies · chains C, D
  • SO4 · Sulfate ion · ion · 2 copies · chains C, D
  • CL · Chloride ion · ion · chains A

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

Pockets

16 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11550.600.8330empty
21090.540.8326empty
31460.540.8130empty
41330.530.8127empty
51730.510.7830empty

Interfaces

4 interfaces between chains.

  • A–C · 1197 Ų buried · 24 hydrogen bonds · protein-protein
  • B–D · 1195 Ų buried · 25 hydrogen bonds · protein-protein
  • A–D · 513 Ų buried · 5 hydrogen bonds · protein-protein
  • B–C · 501 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 4RA0 · An engineered axl 'decoy receptor' effectively silences the GAS6-axl signaling axis · the same entry in another collection · chain A against A, TM-score 1.00
  • P30530 · AlphaFold monomer V2.0 prediction for tyrosine-protein kinase receptor ufo (P30530) · a predicted model of the same protein · chain C against A, TM-score 0.92

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