Structure of IDP95479

2.6 Angstrom Crystal Structure of S-adenosylhomocysteinase from Cryptosporidium parvum in Complex with Aristeromycin and NAD

Edit deposit information
CSGID target
IDP95479 
PDB Id
5TJ9 (NCBI MMDB
Authors
G.Minasov,L.Shuvalova,O.Kiryukhina,I.Dubrovska,B.Bishop,K.Kwon,W.F.Anderson,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
George Minasov 
Responsible lab
Northwestern University 
Deposition Date
Oct 04, 2016 
Release Date
Oct 19, 2016 

Annotation

Ligands

Ligand code Name Ligand type
7CY (1r,2s,3r,5r)-3-(6-amino-9h-purin-9-yl)-5-(hydroxymethy l)cyclopentane-1,2-diol biological
NAD biological
SO4 crystallization
P6G hexaethylene glycol crystallization
GOL crystallization
PEG crystallization

Structure information

Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=66.33Å, b=184.90Å, c=102.51Å
α=90.00, β=107.80, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
29.88-2.60Å (2.67-2.60Å)  
Rall(%)
17.1 
Rwork(%)
16.8 (26.0) 
Rfree(%)
21.8 (29.6) 
Num. observed reflections
72019 (5275) 
Num. Rfree reflections
3744 (263) 
Completeness(%)
99.9 (99.9) 

Model parameters

Num Atoms
15692  
Num Waters
381  
Num Hetatoms
765  
Model mean isotropic B factor
56.920Å2  
RMSD bond length
0.008Å  
RMSD bond angle
1.452°  
Filename uploaded
5tj9.pdb (uploaded on Nov 08, 2016 3:58 PM)  
Inserted
Nov 08, 2016