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MolNFT v1 · #171855 · protein

Bovine ATP synthase stator domain, state 2

6ZIT · ATP synthase protein 8: “Bovine ATP synthase stator domain, state 2”. Electron microscopy, 20 pockets (best druggability 0.78). MolNFT v1 #171855 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ZIT
Type
protein
Length
1,300 residues
Chains
15
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP synthase protein 8; ATP synthase subunit a; ATP synthase subunit D, mitochondrial…
UniProt
P03929, P00847, P13620, Q00361, Q28851, Q28852, P14790, Q3ZBI7, P07926, P13619, P02721, P13621, P19483
Pockets
20 · best druggability 0.78

Structure

electron microscopy · 15 distinct chains · 69% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
8ATP synthase protein 8protein3861% helix, 0% strandP03929
aATP synthase subunit aprotein22677% helix, 0% strandP00847
dATP synthase subunit D, mitochondrialprotein15465% helix, 0% strandP13620
eATP synthase subunit E, mitochondrialprotein4183% helix, 0% strandQ00361
fATP synthase subunit F, mitochondrialprotein8364% helix, 1% strandQ28851
gATP synthase subunit G, mitochondrialprotein7976% helix, 1% strandQ28852
jATP synthase subunit ATP5MPL, mitochondrialprotein4879% helix, 0% strandP14790
kATP synthase membrane subunit dapit, mitochondrialprotein3669% helix, 0% strandQ3ZBI7
RATP synthase F(0) complex subunit C2, mitochondrialprotein5788% helix, 0% strandP07926
KATP synthase F(0) complex subunit C2, mitochondrialprotein5883% helix, 0% strandP07926
LATP synthase F(0) complex subunit C2, mitochondrialprotein3194% helix, 0% strandP07926
bATP synthase F(0) complex subunit B1, mitochondrialprotein20984% helix, 2% strandP13619
hATP synthase-coupling factor 6, mitochondrialprotein6255% helix, 0% strandP02721
SATP synthase subunit O, mitochondrialprotein8943% helix, 28% strandP13621
CATP synthase subunit alpha, mitochondrialprotein8912% helix, 39% strandP19483

Pockets

20 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17420.780.8267empty
24200.770.8640empty
3950.760.9721empty
44230.750.8454empty
53200.740.8640empty

Interfaces

30 interfaces between chains.

  • d–b · 3028 Ų buried · 22 hydrogen bonds · protein-protein
  • 8–a · 1525 Ų buried · 10 hydrogen bonds · protein-protein
  • b–h · 1372 Ų buried · 15 hydrogen bonds · protein-protein
  • a–b · 1202 Ų buried · 11 hydrogen bonds · protein-protein
  • R–K · 1052 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (methylation).

Compared structures

  • 6ZIT · bovine ATP synthase Stator domain, state 2 · the same entry in another collection · chain j against j, TM-score 1.00

Analyse

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