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MolNFT v1 · #122604 · protein

Crystal structure of zebrafish protocadherin-19 EC1-4

5IU9 · Protocadherin-19 isoform 1: “Crystal structure of zebrafish protocadherin-19 EC1-4”. X-ray diffraction, 2 ligands (CA, NA), 9 pockets (best druggability 0.68). MolNFT v1 #122604 on GenesisL1: 3D structure, binding sites and pockets…

PDB
5IU9
Type
protein
Length
839 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protocadherin-19 isoform 1
UniProt
C4P340
Ligands
CA, NA
Pockets
9 · best druggability 0.68

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtocadherin-19 isoform 1protein4177% helix, 42% strandC4P340
BProtocadherin-19 isoform 1protein4226% helix, 41% strandC4P340

Ligands and binding sites

  • CA · Calcium ion · metal · 18 copies · chains A, B
  • NA · Sodium ion · metal · 2 copies · chains A, B

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

Pockets

9 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15980.680.7755empty
21240.570.8327empty
33330.560.7637empty
41980.530.7828empty
51130.460.7926empty

Interfaces

1 interface between chains.

  • A–B · 1765 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5IU9 · Crystal Structure of Zebrafish Protocadherin-19 EC1-4 · the same entry in another collection · chain A against A, TM-score 1.00

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