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MolNFT v1 · #167623 · protein

Mammalian V-ATPase from rat brain membrane-embedded vo region rotational state 3 (from focused refinement)

6VQH · ATPase H+-transporting V1 subunit D: “Mammalian V-ATPase from rat brain membrane-embedded vo region rotational state 3 (from focused refinement)”. Electron microscopy, 20 pockets (best druggability 0.84). MolNFT v1 #167623 on…

PDB
6VQH
Type
protein
Length
2,813 residues
Chains
18
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATPase H+-transporting V1 subunit D; V-type proton ATPase subunit F; V-type proton ATPase…
UniProt
Q6P503, P50408, P25286, B0K022, O54715, Q5M7T6, Q5EB76, D3ZIM6, P63081, Q6AXS4
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 10 distinct chains · 67% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HATPase H+-transporting V1 subunit Dprotein10455% helix, 13% strandQ6P503
LV-type proton ATPase subunit Fprotein11035% helix, 18% strandP50408
aV-type proton ATPase 116 kda subunit a isoform 1protein44167% helix, 2% strandP25286
bATPase, H+ transporting, V0 subunit B (predicted), isoform CRA_Aprotein20379% helix, 0% strandB0K022
cV-type proton ATPase subunit S1protein4161% helix, 0% strandO54715
dV-type proton ATPase subunitprotein35066% helix, 0% strandQ5M7T6
eV-type proton ATPase subunit E 2protein7865% helix, 1% strandQ5EB76
fRibonuclease Kprotein8474% helix, 0% strandD3ZIM6
g, h, i, j, k, l, m, n, oV-type proton ATPase 16 kda proteolipid subunitprotein15085% helix, 0% strandP63081
pRenin receptorprotein5260% helix, 0% strandQ6AXS4

Pockets

20 pockets found on a 1 Å grid, 15 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17300.840.87127empty
29340.830.8469empty
311680.820.83104empty
411320.790.8097empty
56670.720.7867empty

Interfaces

39 interfaces between chains.

  • H–L · 1811 Ų buried · 15 hydrogen bonds · protein-protein
  • b–o · 1733 Ų buried · 7 hydrogen bonds · protein-protein
  • i–j · 1606 Ų buried · 4 hydrogen bonds · protein-protein
  • m–n · 1587 Ų buried · 6 hydrogen bonds · protein-protein
  • b–g · 1580 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 6VQH · Mammalian V-ATPase from rat brain membrane-embedded Vo region rotational state 3 (from… · the same entry in another collection · chain p against p, TM-score 1.00

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