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MolNFT v1 · #179874 · protein

Crystal structure of the mouse lipin-1 M-lip domain with zinc

7KIL · Isoform 2 of phosphatidate phosphatase LPIN1: “Crystal structure of the mouse lipin-1 M-lip domain with zinc”. X-ray diffraction, 2 ligands (ZN, CL), 1 pocket (best druggability 0.35). MolNFT v1 #179874 on GenesisL1: 3D structure…

PDB
7KIL
Type
protein
Length
174 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Isoform 2 of phosphatidate phosphatase LPIN1
UniProt
Q91ZP3
Ligands
ZN, CL
Pockets
1 · best druggability 0.35

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIsoform 2 of phosphatidate phosphatase LPIN1protein8848% helix, 14% strandQ91ZP3
BIsoform 2 of phosphatidate phosphatase LPIN1protein8649% helix, 14% strandQ91ZP3

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains A, B
  • CL · Chloride ion · ion · 11 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1720.350.7619ZN

Interfaces

1 interface between chains.

  • A–B · 1290 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 7KIL · Crystal structure of the mouse lipin-1 M-Lip domain with zinc · the same entry in another collection · chain A against A, TM-score 1.00
  • Q91ZP3 · AlphaFold monomer V2.0 prediction for phosphatidate phosphatase LPIN1 (Q91ZP3) · a predicted model of the same protein · chain B against A, TM-score 0.98

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