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MolNFT v1 · #190125 · protein

Cryo-EM structure of E.COLI ftsh-hflkc aaa protease complex

7WI3 · Modulator of ftsh protease hflc: “Cryo-EM structure of E.COLI ftsh-hflkc aaa protease complex”. Electron microscopy, 20 pockets (best druggability 0.84). MolNFT v1 #190125 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7WI3
Type
protein
Length
8,688 residues
Chains
48
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Modulator of ftsh protease hflc; Modulator of ftsh protease hflk; ATP-dependent zinc…
EC
3.4.24.-
UniProt
P0ABC3, P0ABC7, P0AAI3
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 7 distinct chains · 48% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, Y, Z, MModulator of ftsh protease hflcprotein29351% helix, 12% strandP0ABC3
B, F, G, a, i, k, b, j, l, N, R, SModulator of ftsh protease hflkprotein27553% helix, 17% strandP0ABC7
C, c, d, OModulator of ftsh protease hflcprotein28752% helix, 15% strandP0ABC3
D, e, f, PModulator of ftsh protease hflcprotein29051% helix, 13% strandP0ABC3
E, H, g, m, h, n, Q, TATP-dependent zinc metalloprotease ftsh (EC 3.4.24.-)protein8130% helix, 28% strandP0AAI3
I, K, L, o, s, u, p, t, v, U, W, XATP-dependent zinc metalloprotease ftsh (EC 3.4.24.-)protein7929% helix, 27% strandP0AAI3
J, q, r, VATP-dependent zinc metalloprotease ftsh (EC 3.4.24.-)protein7833% helix, 24% strandP0AAI3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16400.840.89107empty
29730.810.82106empty
34520.810.8985empty
49620.810.8296empty
511900.800.81102empty

Interfaces

120 interfaces between chains.

  • Z–b · 4377 Ų buried · 19 hydrogen bonds · protein-protein
  • M–N · 4288 Ų buried · 20 hydrogen bonds · protein-protein
  • Y–a · 4268 Ų buried · 15 hydrogen bonds · protein-protein
  • A–B · 4257 Ų buried · 21 hydrogen bonds · protein-protein
  • D–G · 4253 Ų buried · 37 hydrogen bonds · protein-protein

Compared structures

  • 7WI3 · Cryo-EM structure of E.Coli FtsH-HflkC AAA protease complex · the same entry in another collection · chain K against K, TM-score 1.00

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