Table 4.
Ligand | Docking interaction | |||||
---|---|---|---|---|---|---|
HDAC 4 | HDAC 5 | HDAC 6 | HDAC 7 | HDAC 9 | HDAC 10 | |
SAHA | Zn2+, Asp287, His155, His 195 | Zn2+, Asp272, His 140 | Zn2+, His32, His33, Tyr204 | Zn2+, Asp191, His153, His154 | Zn2+, Asp188, His22, His150, His151 | Zn2+, Asp226, His95, His96, Phe163, Tyr266 |
2b | Zn2+, Asp193, Glu117, His155, Pro162, Tyr167 | Zn2+, His140 | Zn2+, Ala39, Asp71, His32, His33, Gly202 | Zn2+, Ala160, Glu115, His153, Phe163, Thr109, Thr111 | Zn2+, Asp188, His150, His151, Pro220 | Zn2+, Asn103, Asp133, His95, Phe163 |
2c | Zn2+, Asp193, His155 | Zn2+, Asp178, His140 | Zn2+, His32, His33, Tyr204 | Zn2+, Asp191, Glu115, His153, Thr109, Thr111 | Zn2+, Asp188, Gly322, His150, His151 | Zn2+, Asp133, His95, His96, Phe163 |
2d | Zn2+, Asp193, His155, Tyr167 | Zn2+ ,Asp178, His140, His141, Glu102 | Zn2+, His32, His33, Tyr204 | Zn2+, His153, His154, Phe163 | Zn2+, Asn217, Asp188, His190 | Zn2+, Asn103, Asp133, His95, His96, Tyr266 |
2e | Zn2+, Asp193, His155 | Zn2+, Asp178, His140, Tyr60 | Zn2+, Gly99, His32, His33, Tyr204 | Zn2+, Asp285, Glu115, Gly326 | Zn2+, Asp188, His150, His151, His190, Ser19, Thr20 | Zn2+, Asp133, Gln98, His96, Phe163 |
2f | Zn2+, Asp193, His155, His195 | Zn2+, Asp178, His140, Phe209 | Zn2+, His32, Thr100 | Zn2+, Asp110, Asp285, His153, His154 | Zn2+, Asp188, Asp217, Gly322, His150, His151 | Zn2+, Asn103, Asp133, His95, His96, |
* Bold is the catalytic sites..