7HTL | pdb_00007htl


W1P: 5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

W1P is a Ligand Of Interest in 7HTL designated by the Author
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Best-fitted instance in this entry
Other instances in this entry
Best-fitted instance in this entry
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
7HTL_W1P_B_401 100% 4% 0.03 0.992.72 2.88 1 300100%0.83
7HTL_W1P_A_401 100% 4% 0.033 0.9882.78 2.82 1 300100%0.81
7HTL_W1P_B_402 100% 4% 0.038 0.9842.92 2.92 1 400100%0.83
7HTL_W1P_A_402 99% 4% 0.049 0.9782.9 2.82 1 400100%0.81
7H7G_W1P_D_206 76% 91% 0.078 0.9130.29 0.3 - -00100%0.72
7HID_W1P_C_304 29% 94% 0.157 0.8150.2 0.22 - -00100%0.57
7GP5_W1P_B_201 25% 93% 0.153 0.7890.21 0.25 - -00100%0.76
5S3I_W1P_B_601 20% 93% 0.181 0.7810.2 0.26 - -00100%0.52
5S52_W1P_B_505 9% 64% 0.452 0.950.56 0.8 - 130100%0.83