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MolNFT v1 · #118988 · protein

Bovine mitochondrial ATP synthase state 3A

5FIK · ATP synthase subunit alpha, mitochondrial: “Bovine mitochondrial ATP synthase state 3A”. Electron microscopy, 20 pockets (best druggability 0.81). MolNFT v1 #118988 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5FIK
Type
protein
Length
4,638 residues
Chains
22
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATP synthase subunit alpha, mitochondrial; ATP synthase subunit beta, mitochondrial; ATP…
EC
3.6.3.14
UniProt
P19483, P00829, P05631, P05630, P05632, P32876, P13621, P13619, P13620, P02721, P00847
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 14 distinct chains · 47% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AATP synthase subunit alpha, mitochondrialprotein50941% helix, 20% strandP19483
BATP synthase subunit alpha, mitochondrialprotein48041% helix, 21% strandP19483
CATP synthase subunit alpha, mitochondrialprotein48742% helix, 19% strandP19483
DATP synthase subunit beta, mitochondrial (EC 3.6.3.14)protein46738% helix, 22% strandP00829
E, FATP synthase subunit beta, mitochondrial (EC 3.6.3.14)protein46639% helix, 20% strandP00829
GATP synthase subunit gamma, mitochondrialprotein26454% helix, 12% strandP05631
HATP synthase subunit delta, mitochondrialprotein13128% helix, 40% strandP05630
IATP synthase subunit epsilon, mitochondrialprotein4747% helix, 6% strandP05632
J, K, L, M, N, O, P, QATP synthase F(0) complex subunit C1, mitochondrialprotein7267% helix, 0% strandP32876
SATP synthase subunit O, mitochondrialprotein16736% helix, 0% strandP13621
TATP synthase F(0) complex subunit B1, mitochondrialprotein17489% helix, 0% strandP13619
UATP synthase subunit D, mitochondrialprotein12164% helix, 0% strandP13620
VATP synthase-coupling factor 6, mitochondrialprotein6650% helix, 0% strandP02721
WATP synthase subunit beta, mitochondrialprotein21782% helix, 0% strandP00847

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18540.810.85133empty
28120.810.85137empty
310240.770.80157empty
411630.760.7987empty
56730.740.81116empty

Interfaces

31 interfaces between chains.

  • L–M · 552 Ų buried · 5 hydrogen bonds · protein-protein
  • J–Q · 535 Ų buried · 5 hydrogen bonds · protein-protein
  • P–Q · 525 Ų buried · 4 hydrogen bonds · protein-protein
  • K–L · 507 Ų buried · 3 hydrogen bonds · protein-protein
  • N–O · 499 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 5FIK · Bovine mitochondrial ATP synthase state 3a · the same entry in another collection · chain K against K, TM-score 1.00

Analyse

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