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MolNFT v1 · #184761 · protein

Cryo EM structure of bison NHA2 in nano disc structure

7P1K · Mitochondrial SODIUM/HYDROGEN exchanger 9B2: “Cryo EM structure of bison NHA2 in nano disc structure”. Electron microscopy, 2 ligands (Y01, T7X), 20 pockets (best druggability 0.73). MolNFT v1 #184761 on GenesisL1: 3D structure…

PDB
7P1K
Type
protein
Length
866 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mitochondrial SODIUM/HYDROGEN exchanger 9B2
UniProt
A0A6P3HVI0
Ligands
Y01, T7X
Pockets
20 · best druggability 0.73

Structure

electron microscopy · 1 distinct chain · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B, AMitochondrial SODIUM/HYDROGEN exchanger 9B2protein43374% helix, 0% strandA0A6P3HVI0

Ligands and binding sites

  • Y01 · Cholesterol hemisuccinate · ligand · 8 copies · chains B, A
  • T7X · Phosphatidylinositol · ligand · 4 copies · chains B, A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16500.730.7985empty
25710.730.8065empty
31870.510.7723empty
42160.480.7535empty
52380.480.7330empty

Interfaces

1 interface between chains.

  • B–A · 1455 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 7P1K · Cryo EM structure of bison NHA2 in nano disc structure · the same entry in another collection · chain B against B, TM-score 1.00

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