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MolNFT v1 · #42747 · protein

Solution structure of synechococcus sp. pcc 7002 hemoglobin

2KSC · Cyanoglobin: “Solution structure of synechococcus sp. pcc 7002 hemoglobin”. Solution nmr, 1 ligand (HEB), 2 pockets (best druggability 0.70). MolNFT v1 #42747 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2KSC
Type
protein
Length
123 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cyanoglobin
UniProt
Q8RT58
Ligands
HEB
Pockets
2 · best druggability 0.70

Structure

solution nmr · 1 distinct chain · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACyanoglobinprotein12374% helix, 0% strandQ8RT58

Ligands and binding sites

  • HEB · Heme B/C · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13780.700.8236HEB
2870.450.7917empty

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 2KSC · Solution structure of Synechococcus sp. PCC 7002 hemoglobin · the same entry in another collection · chain A against A, TM-score 1.00

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