# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-08-10T14:38:29+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Biochemistry') AND volume = 58 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1552500","5.8712","0.0002","15.8059","0.0005","9.0571","0.0003","90","","94.6669","0.0008","90","","837.71","0.05","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N O4 S -","- C8 H7 N O4 S -","- C32 H28 N4 O16 S4 -","4","1","","Mcleod, Matthew J.; Krismanich, Anthony P.; Assoud, Abdeljalil; Dmitrienko, Gary I.; Holyoak, Todd","Characterization of 3-[(Carboxymethyl)thio]picolinic Acid: A Novel Inhibitor of Phosphoenolpyruvate Carboxykinase.","Biochemistry","2019","58","37","3918","3926","10.1021/acs.biochem.9b00583","","","0.71073","MoKα","","0.0348","0.029","","","0.0745","0.0786","","","","","","1.064","","","","has coordinates","220331","2020-10-21","18:00:00",""
"1552501","32.35","0.02","6.672","0.004","8.016","0.005","90","","103.59","0.02","90","","1681.7","1.8","100","","100","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C18 H21 Cl N2 O5 -","- C18 H21 Cl N2 O5 -","- C72 H84 Cl4 N8 O20 -","4","1","","Shi, Taoda; Wijeratne, E. M. Kithsiri; Solano, Cristian; Ambrose, Andrew J.; Ross, Alison B.; Norwood, Charles; Orido, Charles K.; Grigoryan, Tigran; Tillotson, Joseph; Kang, Minjin; Luo, Gang; Keegan, Bradley M.; Hu, Wenhao; Blagg, Brian S. J.; Zhang, Donna D.; Gunatilaka, A. A. Leslie; Chapman, Eli","An Isoform-Selective PTP1B Inhibitor Derived from Nitrogen-Atom Augmentation of Radicicol.","Biochemistry","2019","58","30","3225","3231","10.1021/acs.biochem.9b00499","","","0.71073","MoKα","","0.0663","0.043","","","0.1062","0.1227","","","","","","0.802","","","","has coordinates","301780","2025-08-18","21:43:26",""