WRKY variants | Pre-simulated docked complex | Post-simulated docked complex | ||
---|---|---|---|---|
 | Hydrogen bond | Hydrophobic interactions | Hydrogen bond | Hydrophobic interactions |
Wild-type | Arg13-DA28 (2.9Â Ã…), Gln17-DG8 (2.8Â Ã…) Lys18-DT6 (2.9Â Ã…, Lys18-DT7 (2.9Â Ã…), Lys31-DG29 (2.7Â Ã…), Arg40-DG30 (2.9Â Ã…,2.9Â Ã…) | Val19, Pro26 | Arg13-DA29 (3.0Â Ã…), Lys14-DA28(2.9Â Ã…), Gln17-DA8(2.8Â Ã…) | Asn25, Arg45, Lys51 |
Variant I | Gly16-DG8 (2.8Â Ã…), Lys18-DT7 (2.8Â Ã…), Arg49-DG30 (2.7Â Ã…), Thr60-DA28 (2.9Â Ã…) | Tyr15, Ser21, Tyr29, Arg31, Lys35, Pro41, Thr43, Met51, Ser52, Thr58, Tyr61 | Lys18-DT6 (2.9Â Ã…), Ser21-DC4 (2.8Â Ã…), Arg27-DG29(2.9Â Ã…), Arg27-DG30(2.7Â Ã…) | Leu20, Asn22, Tyr29 |
Variant II | Lys18-DT7 (2.8Â Ã…), Lys49-DG30 (2.7Â Ã…) | Tyr15, Ser21, Tyr29, Arg31, Lys35, Pro41, Thr43, Met51, Ser52, Thr58, Tyr61 | Ser21-DT7 (2.7Â Ã…), Ser23-DG29 (2.7Â Ã…), Asn24-DG30 (2.9Â Ã…), Arg31-DA9 (2.8Â Ã…, 2.8Â Ã…) | Tyr15, Lys18, Asn22, Arg27, Lys35, Lys49 |