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MolNFT v1 · #52592 · protein

RNase a-5'-ATP complex

2W5G · Ribonuclease pancreatic: “RNase a-5'-ATP complex”. X-ray diffraction, 1 ligand (ATP), 1 pocket (best druggability 0.50). MolNFT v1 #52592 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2W5G
Type
protein
Length
248 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonuclease pancreatic
EC
3.1.27.5
UniProt
P61823
Ligands
ATP
Pockets
1 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 21% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRibonuclease pancreatic (EC 3.1.27.5)protein12421% helix, 35% strandP61823

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11910.500.7728empty

Interfaces

1 interface between chains.

  • A–B · 302 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 2W5G · RNase a-5'-ATP complex · the same entry in another collection · chain A against A, TM-score 1.00

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