GL1X · GenesisL1 explorer

MolNFT v1 · #52956 · protein

Structure of oryza sativa (rice) PLA2

2WG7 · Putative phospholipase A2: “Structure of oryza sativa (rice) PLA2”. X-ray diffraction, 2 ligands (CA, NA), 2 pockets (best druggability 0.70). MolNFT v1 #52956 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2WG7
Type
protein
Length
240 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative phospholipase A2
EC
3.1.1.4
UniProt
Q9XG81
Ligands
CA, NA
Pockets
2 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative phospholipase A2 (EC 3.1.1.4)protein12144% helix, 7% strandQ9XG81
BPutative phospholipase A2 (EC 3.1.1.4)protein11945% helix, 8% strandQ9XG81

Ligands and binding sites

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

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
14170.700.8169empty
23650.610.7735empty

Interfaces

1 interface between chains.

  • A–B · 1037 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 disulfide (disulfide).

Compared structures

  • 2WG7 · Structure of Oryza Sativa (Rice) PLA2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9XG81 · AlphaFold monomer V2.0 prediction for probable phospholipase A2 homolog 2 (Q9XG81) · a predicted model of the same protein · chain B against A, TM-score 0.99

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