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Vchtnsc aaa+ with DNA (double heptamer)

Analyse Vchtnsc aaa+ with DNA (double heptamer) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7UFM
Type
protein + DNA
Length
4,426 residues
Chains
16
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vchtnsc; DNA (36-mer)
Ligands
ATP
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 3 distinct chains · 45% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, L, M, NVchtnscprotein31145% helix, 5% strand—
ODNA (36-mer)dna36——
PDNA (36-mer)dna36——

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 14 copies · chains A, B, C, D, E, F, G, H, I, J, K, L, M, N

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17140.820.8679ATP
27010.820.8689ATP
36780.810.8672empty
48640.810.8484ATP
57690.810.8481ATP

Interfaces

45 interfaces between chains.

  • O–P · 1614 Ų buried · 204 hydrogen bonds · nucleic-nucleic
  • K–L · 1540 Ų buried · 19 hydrogen bonds · protein-protein
  • A–B · 1517 Ų buried · 15 hydrogen bonds · protein-protein
  • H–I · 1514 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 1514 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 7UFM · VchTnsC AAA+ with DNA (double heptamer) · the same entry in another collection · chain A against A, TM-score 1.00

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