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. 2014 Jul 7;19(7):9591–9605. doi: 10.3390/molecules19079591

Table 2.

Atomic distances obtained by molecular docking procedure. The atoms O1 and H2 were numbered using 2D structure of KA as show in Table 1. All distances are calculated in Å.

KA Analogue Atom AbTYR Atom Distance
INH1 O1
H2		 Cu2+ A
OD1 (Asn260)		 3.69
2.91
INH2 3.50
1.82
INH3 3.84
2.04
INH4 3.57
1.74