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Cryoem MAP and model of nitrite reductase at pH 8.1

Analyse Cryoem MAP and model of nitrite reductase at pH 8.1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6KNG
Type
protein
Length
1,002 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Copper-containing nitrite reductase
EC
1.7.2.1
UniProt
P25006
Ligands
CU
Pockets
17 · best druggability 0.82

Structure

electron microscopy · 1 distinct chain · 10% helix, 42% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CCopper-containing nitrite reductase (EC 1.7.2.1)protein33410% helix, 42% strandP25006

Ligands and binding sites

  • CU · Copper (II) ion · metal · 6 copies · chains A, C, B

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

Pockets

17 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17050.820.8649empty
23290.810.9132empty
31060.770.9718empty
41090.770.9619empty
5990.760.9618empty

Interfaces

3 interfaces between chains.

  • A–C · 2156 Ų buried · 28 hydrogen bonds · protein-protein
  • B–C · 2150 Ų buried · 28 hydrogen bonds · protein-protein
  • A–B · 2140 Ų buried · 28 hydrogen bonds · protein-protein

Compared structures

  • 6KNG · CryoEM map and model of Nitrite Reductase at pH 8.1 · the same entry in another collection · chain A against A, TM-score 1.00

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