Table 1: Total hydrogen bonds and amino acids involved in the binding process.
ENZYME |
NARCISSOSIDE |
APIGENIN |
REMDESIVIR |
REFERENCE Compounds |
||||
HBonds |
A.A |
HBonds |
A.A |
HBonds |
A.A |
HBonds |
A.A |
|
4KRO |
3 |
Arg310 Glu306 |
4 |
Thr406(A), Arg405(A) |
10 |
Ala84 Glu16(2) Lys103, Thr40 |
6 |
Ser342(A), Asp116(B), Arg113(B), Arg405(A) |
4P16 |
6 |
Asn36, Gly37,Cys32, Phe34, Tyr26 |
4 |
Lys205, Ala175, His171 |
2 |
Ala175 |
4 |
Lys205, Ala175, His171 |
6XBG |
12 |
Phe3, Lys5, Glu288 |
6 |
Gly138(B), Glu288(B) |
8 |
Phe3, Arg4, Glu288 |
8 |
Arg4(B), Lys5(A), Lys137(A) |
7BZ5 |
13 |
Glu44, Asp1(L) |
5 |
Pro96 Pro95 |
14 |
Gly42, Pro169 Glu150 |
5 |
Arg1(L) |
7BTF
|
8 |
Arg249, Thr246, Pro677, Tyr456, Thr394 |
5 |
Thr462, Met629, Asn459, Arg349 |
4 |
Tyr619 Asp618 Lys621 |
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