2YQ: (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2,4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one

2YQ is a Ligand Of Interest in 4UND designated by the RCSB


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UND_2YQ_A_2011Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UND_2YQ_A_2011Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UND_2YQ_A_2011Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0
Best-fitted instance in this entry
Created with Raphaël 2.3.0
Other instances in this entry
Created with Raphaël 2.3.0
Best-fitted instance in this entry
Created with Raphaël 2.3.0
Best-fitted PDB instances with same target (top 5)
Created with Raphaël 2.3.0
Best-fitted instance in this entry
Created with Raphaël 2.3.0
Best-fitted PDB instances with different target (top 5)
IdentifierRanking for goodness of fit Ranking for geometry Real space R factor Real space correlation coefficient RMSZ-bond-length RMSZ-bond-angleOutliers of bond length Outliers of bond angle Atomic clashesStereochemical errorsModel completenessAverage occupancy
4UND_2YQ_A_2011 19% 1% 0.184 0.7795.64 3.17 10 1520100%1
4UND_2YQ_B_2011 9% 3% 0.234 0.7193.52 2.89 9 1300100%1
7KK3_2YQ_A_9001 80% 62% 0.128 0.9760.53 0.91 - 300100%1
7KKN_2YQ_B_9002 95% 35% 0.068 0.9740.98 1.55 - 700100%1
4PJT_2YQ_A_1105 88% 9% 0.095 0.9711.92 2.46 5 1100100%1
4PJV_2YQ_B_601 79% 9% 0.11 0.9562.16 2.26 6 1010100%1