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MolNFT v1 · #29506 · protein

Crystal structure of A.FULGIDUS RIO2 kinase complexed with ATP and manganese ions

1ZAO · RIO2 serine kinase: “Crystal structure of A.FULGIDUS RIO2 kinase complexed with ATP and manganese ions”. X-ray diffraction, 3 ligands (ATP, MN, PO4), 2 pockets (best druggability 0.62). MolNFT v1 #29506 on GenesisL1: 3D structure…

PDB
1ZAO
Type
protein
Length
271 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RIO2 serine kinase
UniProt
O30245
Ligands
ATP, MN, PO4
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARIO2 serine kinaseprotein27144% helix, 21% strandO30245

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · chains A
  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • PO4 · Phosphate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 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
12910.620.7929MN, PO4, ATP
2690.340.7618empty

Compared structures

  • 1ZAO · Crystal Structure of A.fulgidus Rio2 Kinase Complexed With ATP and Manganese Ions · the same entry in another collection · chain A against A, TM-score 1.00
  • O30245 · AlphaFold monomer V2.0 prediction for rio-type SERINE/THREONINE- protein kinase RIO2… · a predicted model of the same protein · chain A against A, TM-score 0.98

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