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. 2015 Feb 4;2015:670181. doi: 10.1155/2015/670181

Table 5.

Results of docking studies for reported pyrazole-4-carboxylic acid molecules and their binding interactions with residues within 3 Å radius.

Reference compound Number of hydrogen bonds Hydrogen bond distance Functional group of compounds Functional group of amino acids Residue number
R4 1 2.280 –N –OH Ser289
R5 1 2.639 –C=O –OH Ser289
R6 1 2.659 –CN –NH Ser342
R7 1 2.138 –O–CH3 –OH Tyr473
R8 1 2.824 –OH –C=O Leu340
R9 2 2.606 –OH –O–C=O Glu291
2.067 –NH –C=O Gln271
R10 1 2.324 –C=O –OH Ser289