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MolNFT v1 · #145759 · protein

Cardiac thin filament decorated with C0C1 fragment of cardiac myosin binding protein C mode 1

6CXI · Actin, cytoplasmic 2: “Cardiac thin filament decorated with C0C1 fragment of cardiac myosin binding protein C mode 1”. Electron microscopy, 20 pockets (best druggability 0.82). MolNFT v1 #145759 on GenesisL1: 3D structure, binding…

PDB
6CXI
Type
protein
Length
3,429 residues
Chains
20
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Actin, cytoplasmic 2; Myosin-binding protein C, cardiac-type; Tropomyosin
UniProt
P63261, Q14896
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 5 distinct chains · 50% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, EActin, cytoplasmic 2protein37044% helix, 19% strandP63261
G, H, I, J, K, LMyosin-binding protein C, cardiac-typeprotein1047% helix, 56% strandQ14896
M, N, O, P, QMyosin-binding protein C, cardiac-typeprotein953% helix, 47% strandQ14896
S, TTropomyosinprotein12798% helix, 0% strand—
U, VTropomyosinprotein11398% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12520.820.9445empty
21920.810.9545empty
311620.790.81107empty
42020.790.9340empty
52920.780.9055empty

Interfaces

38 interfaces between chains.

  • S–T · 1713 Ų buried · 0 hydrogen bonds · protein-protein
  • U–V · 1430 Ų buried · 0 hydrogen bonds · protein-protein
  • B–D · 1218 Ų buried · 6 hydrogen bonds · protein-protein
  • A–C · 1176 Ų buried · 9 hydrogen bonds · protein-protein
  • C–E · 1139 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 6CXI · Cardiac thin filament decorated with C0C1 fragment of cardiac myosin binding protein C… · the same entry in another collection · chain K against K, TM-score 1.00

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