Table 2:(6,6-dimethyl-5,6-dihydroimidazo[2,1-b][1,3] thiazol- 3-yl)methyl N,N’-dicyclohexylimidothiocarbamate interaction. | ||||||
Hydrogen bonds |
Polar |
Hydrophobic |
Other |
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N (2) GLU32 – [2.95] (CD, OE1, OE2) |
H (1) GLU32 – [1.95] (OE1, OE2) |
C (6) LEU41 – [3.42] (CD1) |
C (17) ARG30 – [3.88] (CG) |
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N (4) ASP97 – [2.58] (CG,OD1) |
H (3) ASP97 - [2.01] (OD1) |
C (4) LEU41 – [3.81] (CD1) |
H (1) GLU32 – [2.58] (CD, CG) |
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N (3) ASP97 – [3.03] (OD1) |
H (2) ASP97 – [3.57] (OD1) |
C (14) TRP94 – [3.71] (CD1, CG) |
C (15) GLU32 – [3.69] (OO E1, E2) |
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C (13) TRP94 – [3.43] (CD2, CE2, CZ2) |
S (1) GLU32 – [3.74] (OE2) |
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C (3) TRP94 – [3.31] (CE3,CZ3) |
C (1) TYR45 – [3.84] (OH) |
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C (4) ALA98 – [3.84] (CB) |
C (3) TYR45 – [3.23] (OH) |
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C (12) TRP102 – [3.02] (CE3,CH2, CZ3) |
C (7) TYR45 – [3.41] (OH) |
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C (14) TRP102 – [3.89] (CZ3) |
C (4) TYR45 – [3.69] (OH) |
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C (18) ILE185 – [3.79] (CG2) |
C (13) TRP94 – [3.60] (NE1) |
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C (15) ILE185 – [3.54] (CD1) |
H (3) ASP97 – [3.01] (CB,CG) |
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C (11) CYS186 – [3.51] (CB, SG) |
C (12) ASP97 – [3.40] (CB,CG,OD1) |
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C (19) ASP97 – [2.96] (OD1) |
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C (21) ASP97 – [3.72] (OD1) |
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C (1) ASP97 – [3.59] (OD1) |
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C (5) ASP97 – [3.63] (OD1) |
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C (11) ASP97 – [3.59] (OD1) |
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N (2) ILE185 – [3.75] (CD1) |
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H (1) ILE185 – [3.73] (CD1) |
S (1) ILE185 – [3.53] (CD1) |
C (8) ASP187 – [3.14] (OD2) |
C (9) SER285 – [3.14] (OG) |
C (6) SER285 – [3.60] (OG) |
C (7) GLU288 – [3.47] (OE2) |