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MolNFT v1 · #189626 · protein + DNA

Streptomyces coelicolor zinc uptake regulator complexed with zinc and DNA (trimer of dimers)

7VO0 · DNA_NT (84-mer): “Streptomyces coelicolor zinc uptake regulator complexed with zinc and DNA (trimer of dimers)”. Electron microscopy, 1 ligand (ZN), 18 pockets (best druggability 0.75). MolNFT v1 #189626 on GenesisL1: 3D structure…

PDB
7VO0
Type
protein + DNA
Length
872 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA_NT (84-mer); DNA_T (84-mer); Putative metal uptake regulation protein
UniProt
Q9L2H5
Ligands
ZN
Pockets
18 · best druggability 0.75

Structure

electron microscopy · 3 distinct chains · 42% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA_NT (84-mer)dna43——
BDNA_T (84-mer)dna43——
G, H, K, L, M, NPutative metal uptake regulation proteinprotein13142% helix, 21% strandQ9L2H5

Ligands and binding sites

  • ZN · Zinc ion · metal · 18 copies · chains G, H, K, L, M, N

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

Pockets

18 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18020.750.8085empty
210920.720.7680empty
311110.720.7679empty
48760.720.7766empty
5690.640.9219empty

Interfaces

18 interfaces between chains.

  • A–B · 1986 Ų buried · 151 hydrogen bonds · nucleic-nucleic
  • K–L · 1435 Ų buried · 25 hydrogen bonds · protein-protein
  • M–N · 1420 Ų buried · 13 hydrogen bonds · protein-protein
  • G–H · 1408 Ų buried · 14 hydrogen bonds · protein-protein
  • B–N · 474 Ų buried · 3 hydrogen bonds · protein-nucleic

Compared structures

  • 7VO0 · Streptomyces coelicolor zinc uptake regulator complexed with zinc and DNA (trimer of… · the same entry in another collection · chain A against A, TM-score 1.00

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