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MolNFT v1 · #188283 · protein

Yeast ATP synthase state 3CATALYTIC(E) with 10 mm ATP backbone model

7TKS · ATP synthase subunit 9, mitochondrial: “Yeast ATP synthase state 3CATALYTIC(E) with 10 mm ATP backbone model”. Electron microscopy, 20 pockets (best druggability 0.81). MolNFT v1 #188283 on GenesisL1: 3D structure, binding sites and…

PDB
7TKS
Type
protein
Length
5,056 residues
Chains
27
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP synthase subunit 9, mitochondrial; ATP synthase subunit alpha; ATP synthase subunit…
EC
7.1.2.2
UniProt
P61829, P07251, P00830, P38077, Q12165, P21306, P09457, P00854, P05626, P30902, Q06405, Q12349, P81450, P00856
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 20 distinct chains · 47% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
0, 1, 2, 4, 5, 8ATP synthase subunit 9, mitochondrialprotein7588% helix, 0% strandP61829
3, 6, 9ATP synthase subunit 9, mitochondrialprotein7488% helix, 0% strandP61829
7ATP synthase subunit 9, mitochondrialprotein7392% helix, 0% strandP61829
AATP synthase subunit alphaprotein49938% helix, 16% strandP07251
BATP synthase subunit alphaprotein50738% helix, 18% strandP07251
CATP synthase subunit alphaprotein49641% helix, 20% strandP07251
DATP synthase subunit beta (EC 7.1.2.2)protein46835% helix, 20% strandP00830
EATP synthase subunit beta (EC 7.1.2.2)protein46933% helix, 17% strandP00830
FATP synthase subunit beta (EC 7.1.2.2)protein47037% helix, 19% strandP00830
GATP synthase subunit gammaprotein26564% helix, 9% strandP38077
HATP synthase subunit deltaprotein12027% helix, 37% strandQ12165
IATP synthase subunit epsilonprotein4838% helix, 13% strandP21306
OATP synthase subunit 5protein18746% helix, 12% strandP09457
TATP synthase subunit aprotein22471% helix, 1% strandP00854
UATP synthase subunit 4protein15596% helix, 0% strandP05626
VATP synthase subunit Dprotein17158% helix, 0% strandP30902
WATP synthase subunit Fprotein8545% helix, 0% strandQ06405
XATP synthase subunit Hprotein6247% helix, 0% strandQ12349
YATP synthase subunit Jprotein3757% helix, 0% strandP81450
ZATP synthase protein 8protein4881% helix, 0% strandP00856

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18990.810.84127empty
29150.810.84122empty
38720.810.84122empty
47820.750.81133empty
56830.740.81100empty

Interfaces

53 interfaces between chains.

  • B–F · 593 Ų buried · 6 hydrogen bonds · protein-protein
  • A–E · 587 Ų buried · 8 hydrogen bonds · protein-protein
  • C–F · 561 Ų buried · 5 hydrogen bonds · protein-protein
  • B–E · 527 Ų buried · 4 hydrogen bonds · protein-protein
  • 6–7 · 459 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7TKS · Yeast ATP synthase State 3catalytic(e) with 10 mM ATP backbone model · the same entry in another collection · chain Z against Z, TM-score 1.00

Analyse

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