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| PDB | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 3BLQA | 7 | 325 | 372.0 | ATP:332 | ATPlike | Active | DFGin | 6.983 | 15.235 | BLAminus | -137.33, 167.71 | 61.72, 82.78 | -101.54, 27.58 | 292.13, 71.79 | -68.35, -20.47 | in-in | in | 9.514 | Saltbr-in | 3.257 | HRD-in | -70.77, -57.41 | 73.91, 6.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.85 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.28, 155.2 | APE9-dihe-na | 75.14, 129.25 | APE8-dihe-in | -51.14, 147.2 | APE8-rot-in | 304.68 | APE67-dihe-in | -62.86, -25.73 | -50.2, -49.1 | APE12-dist-in | 13.028 | APE11-dist-in | 11.03 | APE10-dist-in | 6.896 | APE9-dist-in | 3.154 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.174 | 0.234 | A | 331 | 296 | 23 | 0 | 0 | 7 | [[19, 315]] | 1.0 | 3blq | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4IMYC | 8 | 330 | 372.0 | AMP:401 | ATPlike | Active | DFGin | 6.789 | 15.123 | BLAminus | -140.61, 175.84 | 60.41, 77.79 | -97.02, 19.01 | 284.69, 80.72 | -68.98, -8.54 | in-in | in | 9.232 | Saltbr-in | 2.833 | HRD-in | -67.68, -50.97 | 65.16, 13.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.928 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.81, 161.81 | APE9-dihe-na | 73.71, 135.92 | APE8-dihe-in | -53.34, 141.57 | APE8-rot-in | 294.85 | APE67-dihe-in | -61.16, -25.06 | -47.9, -50.46 | APE12-dist-in | 13.386 | APE11-dist-in | 11.431 | APE10-dist-in | 7.006 | APE9-dist-in | 3.279 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | C | 332 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4IMYE | 8 | 330 | 372.0 | AMP:401 | ATPlike | Active | DFGin | 6.794 | 15.112 | BLAminus | -141.41, 175.75 | 59.75, 77.9 | -96.66, 19.65 | 284.44, 80.03 | -69.65, -8.18 | in-in | in | 9.197 | Saltbr-in | 2.816 | HRD-in | -68.02, -51.11 | 68.06, 12.23 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.919 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.97, 161.65 | APE9-dihe-na | 74.14, 135.63 | APE8-dihe-in | -53.23, 140.74 | APE8-rot-in | 294.81 | APE67-dihe-in | -59.86, -25.62 | -47.7, -50.88 | APE12-dist-in | 13.405 | APE11-dist-in | 11.437 | APE10-dist-in | 7.01 | APE9-dist-in | 3.278 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | E | 332 | 314 | 9 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3MIAA | 8 | 340 | 372.0 | ANP:352 | ATPlike | Active | DFGin | 6.803 | 15.077 | BLAminus | -137.71, 176.33 | 64.58, 74.97 | -96.55, 26.44 | 284.7, 90.38 | -67.18, -14.54 | in-in | in | 9.313 | Saltbr-in | 2.689 | HRD-in | -70.81, -51.43 | 63.16, 28.9 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.957 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.04, 160.49 | APE9-dihe-na | 82.03, 127.94 | APE8-dihe-in | -49.75, 143.51 | APE8-rot-in | 280.63 | APE67-dihe-in | -52.26, -14.47 | -51.96, -57.94 | APE12-dist-in | 13.258 | APE11-dist-in | 11.524 | APE10-dist-in | 6.949 | APE9-dist-in | 3.523 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.219 | 0.287 | A | 351 | 325 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3mia | CMGC_CDK9_HUMAN | CMGC | 5.1e-80 | 274.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| AF-P50750-K1A | 11 | 323 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.804 | 15.165 | BLAminus | -137.37, 173.37 | 64.39, 60.59 | -77.02, 16.85 | 288.83, 77.77 | -62.06, -30.21 | in-in | in | 8.518 | Saltbr-in | 2.709 | HRD-in | -74.93, -50.16 | 64.15, 10.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.815 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -118.96, 171.33 | APE9-dihe-na | 63.33, 135.53 | APE8-dihe-in | -59.46, 137.0 | APE8-rot-in | 298.24 | APE67-dihe-in | -65.46, -22.86 | -48.78, -43.32 | APE12-dist-in | 13.072 | APE11-dist-in | 11.321 | APE10-dist-in | 6.647 | APE9-dist-in | 3.332 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 313 | 313 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | AF-P50750-K1 | CMGC_CDK9_HUMAN | CMGC | 3.3e-80 | 275.4 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| AF-P50750-K3A | 11 | 323 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.062 | 14.698 | BLAminus | -139.94, 174.92 | 58.53, 50.7 | -65.37, 20.59 | 281.14, 76.16 | -63.5, -35.02 | in-in | in | 8.8 | Saltbr-in | 2.765 | HRD-in | -75.68, -48.0 | 63.0, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.853 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.22, 172.67 | APE9-dihe-na | 61.33, 130.24 | APE8-dihe-in | -58.01, 135.54 | APE8-rot-in | 298.09 | APE67-dihe-in | -65.99, -22.34 | -47.59, -46.0 | APE12-dist-in | 12.586 | APE11-dist-in | 10.571 | APE10-dist-in | 6.205 | APE9-dist-in | 3.367 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 313 | 313 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | AF-P50750-K3 | CMGC_CDK9_HUMAN | CMGC | 3.3e-80 | 275.4 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4OR5A | 8 | 331 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.943 | 14.74 | BLAminus | -124.31, 168.54 | 69.01, 76.04 | -97.31, 28.71 | 289.03, 30.11 | -68.53, -16.51 | in-in | in | 8.982 | Saltbr-in | 2.762 | HRD-in | -69.96, -55.39 | 71.5, 2.58 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.871 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.38, 159.55 | APE9-dihe-na | 76.25, 129.47 | APE8-dihe-in | -55.54, 147.57 | APE8-rot-in | 323.78 | APE67-dihe-in | -55.49, -19.54 | -44.65, -58.02 | APE12-dist-in | 13.144 | APE11-dist-in | 10.903 | APE10-dist-in | 6.784 | APE9-dist-in | 3.212 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.225 | 0.267 | A | 326 | 320 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4or5 | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4OR5F | 8 | 332 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.668 | 14.98 | BLAminus | -111.52, -176.73 | 51.04, 89.5 | -102.8, 24.68 | 281.6, 71.85 | -49.29, -46.03 | in-in | in | 9.212 | Saltbr-in | 2.608 | HRD-in | -63.05, -54.26 | 62.81, 29.79 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.877 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.12, 165.75 | APE9-dihe-na | 70.73, 135.03 | APE8-dihe-in | -51.7, 151.98 | APE8-rot-in | 310.95 | APE67-dihe-in | -54.55, -10.13 | -58.62, -54.74 | APE12-dist-in | 12.948 | APE11-dist-in | 10.819 | APE10-dist-in | 6.534 | APE9-dist-in | 3.443 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.225 | 0.267 | F | 326 | 325 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4or5 | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 5L1ZA | 8 | 330 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.218 | 14.599 | BLAminus | -125.76, -179.91 | 59.3, 75.76 | -100.2, 28.34 | 287.78, 61.41 | -57.18, -56.97 | in-in | in | 8.958 | Saltbr-in | 2.708 | HRD-in | -67.89, -46.91 | 51.73, 43.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.634 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.76, 164.45 | APE9-dihe-na | 64.74, 143.58 | APE8-dihe-in | -57.19, 139.09 | APE8-rot-in | 301.99 | APE67-dihe-in | -68.84, -33.17 | -48.82, -40.87 | APE12-dist-in | 12.93 | APE11-dist-in | 10.747 | APE10-dist-in | 6.633 | APE9-dist-in | 3.47 | None | TPO186 | TPO186 | XRAY | 5.9 | 0.217 | 0.313 | A | 330 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 5l1z | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 6CYTA | 8 | 330 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.128 | 14.819 | BLAminus | -145.42, 171.89 | 59.31, 72.76 | -88.66, 18.9 | 282.04, 75.69 | -58.99, -26.1 | in-in | in | 8.749 | Saltbr-in | 3.085 | HRD-in | -78.56, -48.34 | 62.81, 28.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.77 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.32, 170.8 | APE9-dihe-na | 69.6, 130.71 | APE8-dihe-in | -52.14, 135.55 | APE8-rot-in | 303.56 | APE67-dihe-in | -61.47, -34.74 | -50.37, -43.24 | APE12-dist-in | 13.158 | APE11-dist-in | 11.341 | APE10-dist-in | 6.765 | APE9-dist-in | 3.758 | None | TPO186 | TPO186 | XRAY | 3.5 | 0.251 | 0.283 | A | 332 | 319 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 6cyt | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3MI9A | 8 | 344 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.217 | 15.083 | BLAminus | -131.5, 175.99 | 56.36, 81.19 | -96.49, 22.86 | 283.32, 81.7 | -61.79, -15.23 | in-in | in | 9.37 | Saltbr-in | 2.661 | HRD-in | -69.68, -51.06 | 64.68, 15.58 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.904 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.92, 157.04 | APE9-dihe-na | 77.38, 136.99 | APE8-dihe-in | -56.37, 139.72 | APE8-rot-in | 276.81 | APE67-dihe-in | -58.41, -18.53 | -45.4, -54.86 | APE12-dist-in | 13.481 | APE11-dist-in | 11.309 | APE10-dist-in | 7.271 | APE9-dist-in | 3.269 | None | TPO186 | TPO186 | XRAY | 2.1 | 0.219 | 0.264 | A | 351 | 329 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3mi9 | CMGC_CDK9_HUMAN | CMGC | 5.1e-80 | 274.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4EC8A | 6 | 338 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.021 | 14.71 | BLAminus | -136.31, 174.5 | 61.51, 81.72 | -97.53, 24.16 | 282.28, 73.66 | -54.62, -38.88 | in-in | in | 9.043 | Saltbr-in | 2.941 | HRD-in | -86.88, -43.45 | 62.41, 27.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.86 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -117.08, 171.7 | APE9-dihe-na | 55.16, 133.32 | APE8-dihe-in | -40.35, 153.59 | APE8-rot-in | 304.69 | APE67-dihe-in | -58.26, -42.11 | -57.08, -55.81 | APE12-dist-in | 13.106 | APE11-dist-in | 11.158 | APE10-dist-in | 6.718 | APE9-dist-in | 3.298 | None | TPO186 | TPO186 | XRAY | 3.6 | 0.194 | 0.23 | A | 373 | 326 | 7 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ec8 | CMGC_CDK9_HUMAN | CMGC | 6.3e-80 | 274.7 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4EC9A | 7 | 327 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.963 | 15.031 | BLAminus | -130.28, 170.97 | 63.86, 78.14 | -96.65, 19.21 | 284.99, 81.64 | -66.97, -16.11 | in-in | in | 9.502 | Saltbr-in | 3.167 | HRD-in | -77.71, -44.73 | 68.48, 6.05 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.76 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.99, 139.69 | APE9-dihe-na | 84.51, 133.17 | APE8-dihe-in | -49.64, 141.35 | APE8-rot-in | 313.22 | APE67-dihe-in | -69.04, -23.15 | -49.34, -46.9 | APE12-dist-in | 13.439 | APE11-dist-in | 11.28 | APE10-dist-in | 7.175 | APE9-dist-in | 2.912 | None | TPO186 | TPO186 | XRAY | 3.21 | 0.203 | 0.233 | A | 373 | 307 | 14 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ec9 | CMGC_CDK9_HUMAN | CMGC | 6.3e-80 | 274.7 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4BCFA | 6 | 326 | 372.0 | T6Q:1327 | Type1 | Active | DFGin | 7.035 | 15.006 | BLAminus | -130.89, 175.85 | 58.26, 78.19 | -93.84, 20.92 | 284.01, 74.28 | -69.0, -18.91 | in-in | in | 9.385 | Saltbr-in | 3.454 | HRD-in | -78.09, -44.7 | 68.67, 6.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.871 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -125.92, 149.94 | APE9-dihe-na | 81.04, 132.5 | APE8-dihe-in | -49.66, 140.73 | APE8-rot-in | 291.42 | APE67-dihe-in | -67.27, -22.18 | -50.7, -44.79 | APE12-dist-in | 13.104 | APE11-dist-in | 10.304 | APE10-dist-in | 6.907 | APE9-dist-in | 3.128 | None | TPO186 | TPO186 | XRAY | 3.011 | 0.169 | 0.224 | A | 331 | 308 | 13 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 4bcf | CMGC_CDK9_HUMAN | CMGC | 3.7e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 8I0LA | 6 | 326 | 372.0 | NJ6:401 | Type1 | Active | DFGin | 7.293 | 15.855 | BLAminus | -130.69, 179.52 | 57.03, 69.82 | -94.01, 27.86 | 282.24, 73.6 | -69.08, -49.61 | in-in | in | 9.573 | Saltbr-in | 3.235 | HRD-in | -83.43, -47.61 | 60.01, 23.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.759 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -113.64, 163.64 | APE9-dihe-na | 68.82, 138.39 | APE8-dihe-in | -61.18, 156.44 | APE8-rot-in | 324.35 | APE67-dihe-in | -70.36, -22.43 | -60.05, -41.69 | APE12-dist-in | 12.809 | APE11-dist-in | 10.347 | APE10-dist-in | 6.433 | APE9-dist-in | 3.549 | None | TPO186 | TPO186 | XRAY | 3.6 | 0.235 | 0.257 | A | 332 | 308 | 13 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 8i0l | CMGC_CDK9_HUMAN | CMGC | 3.8e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 6GZHA | 8 | 326 | 372.0 | LCI:2001 | Type1 | Active | DFGin | 6.962 | 15.276 | BLAminus | -143.64, 171.3 | 50.95, 83.68 | -93.37, 33.37 | 284.73, 74.17 | -64.71, -41.34 | in-in | in | 9.645 | Saltbr-in | 2.886 | HRD-in | -65.68, -54.2 | 64.63, 22.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.772 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -139.77, 163.06 | APE9-dihe-na | 70.11, 142.16 | APE8-dihe-in | -60.75, 137.92 | APE8-rot-in | 300.9 | APE67-dihe-in | -63.71, -23.63 | -48.56, -44.41 | APE12-dist-in | 12.829 | APE11-dist-in | 10.306 | APE10-dist-in | 6.58 | APE9-dist-in | 3.427 | None | TPO186 | TPO186 | XRAY | 3.17 | 0.175 | 0.257 | A | 326 | 310 | 9 | 0 | 0 | 3 | [[19, 315]] | 1.0 | 6gzh | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3LQ5A | 6 | 327 | 372.0 | SLQ:331 | Type1 | Active | DFGin | 7.077 | 14.862 | BLAminus | -142.24, 175.94 | 56.62, 82.08 | -95.24, 28.75 | 286.71, 83.42 | -69.95, -28.82 | in-in | in | 9.106 | Saltbr-in | 3.55 | HRD-in | -75.08, -43.56 | 66.05, 12.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.86 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -112.5, 158.49 | APE9-dihe-na | 76.36, 121.96 | APE8-dihe-in | -35.3, 136.84 | APE8-rot-in | 307.0 | APE67-dihe-in | -57.48, -14.79 | -49.62, -56.61 | APE12-dist-in | 13.159 | APE11-dist-in | 10.52 | APE10-dist-in | 6.791 | APE9-dist-in | 3.532 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.165 | 0.215 | A | 331 | 308 | 14 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3lq5 | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3MY1A | 6 | 327 | 372.0 | RFZ:336 | Type1 | Active | DFGin | 6.92 | 14.737 | BLAminus | -138.6, -178.76 | 55.85, 82.27 | -96.58, 26.19 | 286.18, 71.12 | -65.01, -22.99 | in-in | in | 9.174 | Saltbr-in | 3.024 | HRD-in | -74.76, -49.19 | 65.23, 25.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.771 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -108.34, 163.18 | APE9-dihe-na | 70.44, 131.12 | APE8-dihe-in | -41.78, 152.21 | APE8-rot-in | 296.57 | APE67-dihe-in | -62.52, -36.66 | -60.91, -51.23 | APE12-dist-in | 13.127 | APE11-dist-in | 11.22 | APE10-dist-in | 6.853 | APE9-dist-in | 3.38 | None | TPO186 | TPO186 | XRAY | 2.8 | 0.175 | 0.214 | A | 331 | 315 | 7 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3my1 | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3TN8A | 8 | 325 | 372.0 | F18:332 | Type1 | Active | DFGin | 6.928 | 14.758 | BLAminus | -143.85, 178.49 | 57.5, 79.87 | -95.98, 37.06 | 283.24, 76.06 | -66.12, -47.35 | in-in | in | 8.875 | Saltbr-in | 3.079 | HRD-in | -75.16, -50.1 | 67.86, 4.01 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.743 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -105.91, 161.16 | APE9-dihe-na | 76.41, 125.51 | APE8-dihe-in | -47.81, 145.62 | APE8-rot-in | 301.4 | APE67-dihe-in | -65.71, -32.31 | -55.05, -44.31 | APE12-dist-in | 12.863 | APE11-dist-in | 10.197 | APE10-dist-in | 6.704 | APE9-dist-in | 3.197 | None | TPO186 | TPO186 | XRAY | 2.95 | 0.179 | 0.221 | A | 331 | 305 | 13 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3tn8 | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3TNHA | 8 | 328 | 372.0 | F18:400 | Type1 | Active | DFGin | 6.895 | 14.863 | BLAminus | -133.46, 172.31 | 64.77, 76.91 | -97.39, 20.03 | 283.08, 80.82 | -68.17, -17.73 | in-in | in | 9.065 | Saltbr-in | 3.343 | HRD-in | -75.15, -45.06 | 69.35, 5.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.787 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.95, 145.17 | APE9-dihe-na | 82.57, 129.21 | APE8-dihe-in | -52.21, 142.64 | APE8-rot-in | 282.87 | APE67-dihe-in | -68.26, -22.31 | -48.58, -47.58 | APE12-dist-in | 12.85 | APE11-dist-in | 9.703 | APE10-dist-in | 6.867 | APE9-dist-in | 3.198 | None | TPO186 | TPO186 | XRAY | 3.202 | 0.179 | 0.226 | A | 331 | 289 | 32 | 0 | 0 | 7 | [[19, 315]] | 1.0 | 3tnh | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4OGRA | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 6.959 | 14.852 | BLAminus | -145.48, 171.71 | 58.99, 73.11 | -88.05, 19.07 | 282.19, 75.89 | -59.04, -25.77 | in-in | in | 8.622 | Saltbr-in | 3.202 | HRD-in | -78.29, -48.1 | 62.83, 28.93 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.885 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.59, 171.14 | APE9-dihe-na | 70.34, 130.75 | APE8-dihe-in | -51.49, 135.3 | APE8-rot-in | 303.62 | APE67-dihe-in | -61.39, -34.94 | -50.28, -42.94 | APE12-dist-in | 13.245 | APE11-dist-in | 11.482 | APE10-dist-in | 6.706 | APE9-dist-in | 3.205 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | A | 332 | 315 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4OGRE | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 7.086 | 14.749 | BLAminus | -145.95, 172.29 | 59.47, 72.14 | -89.89, 19.36 | 283.65, 75.49 | -58.97, -26.2 | in-in | in | 8.801 | Saltbr-in | 2.931 | HRD-in | -77.91, -48.96 | 62.4, 28.78 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.848 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.99, 169.74 | APE9-dihe-na | 65.95, 134.0 | APE8-dihe-in | -52.43, 138.08 | APE8-rot-in | 303.65 | APE67-dihe-in | -62.11, -36.08 | -50.82, -43.72 | APE12-dist-in | 13.214 | APE11-dist-in | 11.177 | APE10-dist-in | 6.799 | APE9-dist-in | 3.429 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | E | 332 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4OGRI | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 7.02 | 14.857 | BLAminus | -146.32, 171.3 | 58.62, 73.81 | -88.0, 20.33 | 283.45, 75.93 | -58.21, -25.18 | in-in | in | 8.754 | Saltbr-in | 3.252 | HRD-in | -77.88, -47.68 | 62.44, 29.24 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.937 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.71, 169.37 | APE9-dihe-na | 67.96, 131.32 | APE8-dihe-in | -52.01, 135.85 | APE8-rot-in | 303.33 | APE67-dihe-in | -60.26, -34.97 | -51.39, -42.17 | APE12-dist-in | 13.226 | APE11-dist-in | 11.036 | APE10-dist-in | 6.524 | APE9-dist-in | 3.127 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | I | 332 | 319 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 6W9EA | 7 | 326 | 372.0 | TO7:401,TO7:402,TOJ:403,TOJ:404 | Type1,Type1,Type1,Type1 | Active | DFGin | 7.001 | 15.083 | BLAminus | -134.21, 172.07 | 61.13, 81.04 | -94.79, 28.67 | 292.71, 81.0 | -65.23, -42.38 | in-in | in | 9.226 | Saltbr-in | 3.047 | HRD-in | -77.57, -45.55 | 60.07, 27.0 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.794 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.35, 150.83 | APE9-dihe-na | 76.33, 139.44 | APE8-dihe-in | -54.19, 159.88 | APE8-rot-in | 315.27 | APE67-dihe-in | -69.62, -18.61 | -64.18, -47.28 | APE12-dist-in | 12.768 | APE11-dist-in | 10.465 | APE10-dist-in | 6.775 | APE9-dist-in | 3.411 | None | TPO186,SEP306 | TPO186,SEP306 | XRAY | 3.1 | 0.175 | 0.221 | A | 330 | 311 | 9 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 6w9e | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4IMYA | 8 | 330 | 372.0 | AMP:401 | Type1.5_Back | Active | DFGin | 6.761 | 15.126 | BLAminus | -140.16, 177.94 | 57.41, 78.2 | -96.63, 19.81 | 285.27, 81.22 | -68.88, -9.41 | in-in | in | 9.227 | Saltbr-in | 2.849 | HRD-in | -67.2, -51.3 | 65.19, 13.63 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.92 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.99, 161.25 | APE9-dihe-na | 74.17, 135.57 | APE8-dihe-in | -52.35, 140.79 | APE8-rot-in | 295.69 | APE67-dihe-in | -60.8, -24.95 | -48.08, -50.31 | APE12-dist-in | 13.39 | APE11-dist-in | 11.433 | APE10-dist-in | 7.009 | APE9-dist-in | 3.27 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | A | 332 | 315 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3BLHA | 8 | 325 | 372.0 | No_ligand | No_ligand | Inactive | DFGin | 7.105 | 15.617 | BLAminus | -129.9, 170.98 | 63.01, 77.18 | -97.75, 18.52 | 284.97, 81.6 | -67.67, -17.09 | in-out | in | 9.598 | Saltbr-out | 5.608 | HRD-in | -77.19, -44.8 | 68.26, 4.38 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.83, 136.54 | APE9-dihe-na | 82.17, 131.77 | APE8-dihe-in | -51.9, 141.65 | APE8-rot-in | 281.88 | APE67-dihe-in | -68.04, -21.93 | -48.78, -46.05 | APE12-dist-in | 13.097 | APE11-dist-in | 9.69 | APE10-dist-in | 7.388 | APE9-dist-in | 3.169 | None | TPO186 | TPO186 | XRAY | 2.48 | 0.179 | 0.221 | A | 331 | 292 | 26 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 3blh | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3TNIA | 7 | 325 | 372.0 | No_ligand | No_ligand | Inactive | DFGin | 6.96 | 15.518 | BLAminus | -129.67, 172.05 | 64.93, 76.48 | -99.12, 16.83 | 286.41, 84.44 | -68.12, -14.55 | in-out | in | 9.812 | Saltbr-out | 6.519 | HRD-in | -78.02, -45.15 | 68.07, 5.47 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.828 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.05, 143.65 | APE9-dihe-na | 85.09, 131.61 | APE8-dihe-in | -49.91, 142.7 | APE8-rot-in | 287.18 | APE67-dihe-in | -68.03, -22.83 | -48.7, -45.44 | APE12-dist-in | 13.389 | APE11-dist-in | 11.096 | APE10-dist-in | 7.265 | APE9-dist-in | 3.245 | None | TPO186 | TPO186 | XRAY | 3.234 | 0.166 | 0.21 | A | 331 | 298 | 21 | 0 | 0 | 6 | [[19, 315]] | 1.0 | 3tni | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 7NWKA | 7 | 326 | 372.0 | UT5:401 | Type1 | Inactive | DFGin | 7.111 | 14.991 | BLAminus | -124.85, 176.65 | 53.29, 84.25 | -99.42, 22.06 | 284.43, 78.88 | -62.72, -24.1 | in-in | in | 9.188 | Saltbr-in | 3.356 | HRD-in | -72.75, -46.7 | 63.63, 12.3 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.819 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -125.99, 150.18 | APE9-dihe-na | 74.8, 134.0 | APE8-dihe-in | -57.76, 142.58 | APE8-rot-out | 9.44 | APE67-dihe-in | -60.65, -26.29 | -46.55, -51.52 | APE12-dist-in | 12.915 | APE11-dist-in | 10.299 | APE10-dist-in | 6.828 | APE9-dist-in | 3.36 | None | TPO186 | TPO186 | XRAY | 2.81 | 0.182 | 0.205 | A | 330 | 298 | 22 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 7nwk | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 3BLRA | 7 | 326 | 372.0 | CPB:940 | Type1 | Inactive | DFGin | 6.849 | 14.983 | BLAminus | -137.81, 169.59 | 65.05, 86.98 | -102.47, 22.09 | 282.73, 80.55 | -59.33, -27.76 | in-in | in | 9.73 | Saltbr-in | 3.0 | HRD-in | -77.6, -52.79 | 69.15, 9.31 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.838 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -123.25, 157.8 | APE9-dihe-na | 74.85, 130.66 | APE8-dihe-in | -57.24, 143.32 | APE8-rot-out | 21.76 | APE67-dihe-in | -65.59, -31.38 | -41.87, -49.24 | APE12-dist-in | 13.189 | APE11-dist-in | 10.838 | APE10-dist-in | 6.85 | APE9-dist-in | 3.362 | None | TPO186 | TPO186 | XRAY | 2.8 | 0.176 | 0.228 | A | 331 | 301 | 19 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3blr | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4BCGA | 7 | 327 | 372.0 | T3C:1328 | Type1 | Inactive | DFGin | 7.134 | 15.244 | BLAminus | -132.48, 173.97 | 58.32, 78.23 | -93.26, 24.05 | 284.24, 75.68 | -68.96, -23.34 | in-out | in | 9.462 | Saltbr-out | 4.647 | HRD-in | -78.18, -44.27 | 68.6, 10.18 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.878 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.1, 147.31 | APE9-dihe-na | 81.87, 132.15 | APE8-dihe-in | -51.72, 141.44 | APE8-rot-in | 291.43 | APE67-dihe-in | -63.63, -25.74 | -50.67, -46.04 | APE12-dist-in | 13.109 | APE11-dist-in | 10.231 | APE10-dist-in | 6.933 | APE9-dist-in | 3.179 | None | TPO186 | TPO186 | XRAY | 3.085 | 0.163 | 0.197 | A | 331 | 313 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4bcg | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4BCHA | 7 | 327 | 372.0 | T7Z:1328 | Type1 | Inactive | DFGin | 7.022 | 15.251 | BLAminus | -131.52, 173.1 | 62.62, 79.06 | -97.34, 18.94 | 284.72, 72.84 | -65.45, -18.12 | in-out | in | 9.564 | Saltbr-out | 4.337 | HRD-in | -78.74, -44.37 | 68.53, 5.43 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.917 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -98.64, 156.76 | APE9-dihe-na | 81.03, 133.91 | APE8-dihe-in | -51.15, 142.4 | APE8-rot-in | 295.91 | APE67-dihe-in | -66.84, -22.68 | -48.59, -47.41 | APE12-dist-in | 13.267 | APE11-dist-in | 10.899 | APE10-dist-in | 6.912 | APE9-dist-in | 3.181 | None | TPO186 | TPO186 | XRAY | 2.958 | 0.169 | 0.21 | A | 331 | 309 | 12 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 4bch | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4BCIA | 5 | 326 | 372.0 | T3E:1327 | Type1 | Inactive | DFGin | 7.099 | 15.182 | BLAminus | -131.07, 172.91 | 63.16, 77.79 | -97.71, 24.25 | 283.9, 77.6 | -66.92, -23.58 | in-out | in | 9.472 | Saltbr-out | 4.196 | HRD-in | -77.09, -44.37 | 66.65, 15.51 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -105.81, 155.45 | APE9-dihe-na | 82.12, 132.8 | APE8-dihe-in | -46.04, 142.98 | APE8-rot-in | 310.28 | APE67-dihe-in | -70.86, -24.72 | -49.47, -47.11 | APE12-dist-in | 13.101 | APE11-dist-in | 11.156 | APE10-dist-in | 6.828 | APE9-dist-in | 3.348 | None | TPO186 | TPO186 | XRAY | 3.1 | 0.18 | 0.221 | A | 331 | 309 | 13 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 4bci | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 4BCJA | 6 | 326 | 372.0 | T9N:1327 | Type1 | Inactive | DFGin | 7.03 | 15.018 | BLAminus | -131.0, 170.86 | 63.37, 81.25 | -96.53, 22.01 | 287.4, 63.38 | -57.12, -37.16 | in-out | in | 9.444 | Saltbr-out | 4.455 | HRD-in | -79.62, -45.57 | 66.85, 8.76 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.873 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -113.55, 158.16 | APE9-dihe-na | 80.36, 134.65 | APE8-dihe-in | -47.14, 141.93 | APE8-rot-in | 299.93 | APE67-dihe-in | -67.12, -25.13 | -50.6, -47.83 | APE12-dist-in | 13.096 | APE11-dist-in | 11.108 | APE10-dist-in | 6.84 | APE9-dist-in | 3.158 | None | TPO186 | TPO186 | XRAY | 3.162 | 0.162 | 0.207 | A | 331 | 310 | 11 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 4bcj | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 8K5RA | 5 | 327 | 372.0 | VQE:401 | Type1 | Inactive | DFGin | 7.543 | 15.463 | BLAminus | -127.7, -178.83 | 57.51, 52.57 | -82.11, 20.94 | 280.63, 64.24 | -61.34, -43.86 | in-out | in | 9.292 | Saltbr-out | 3.716 | HRD-in | -86.18, -55.67 | 72.35, 16.43 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.709 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.28, 166.1 | APE9-dihe-na | 82.22, 165.84 | APE8-dihe-in | -71.04, 149.98 | APE8-rot-in | 312.55 | APE67-dihe-in | -65.92, -42.72 | -67.97, -33.99 | APE12-dist-in | 12.916 | APE11-dist-in | 11.442 | APE10-dist-in | 6.819 | APE9-dist-in | 3.164 | S7D,V8N,K44R,Y138F,K280A,D307E,N311E | TPO186 | TPO186 | XRAY | 3.751 | 0.203 | 0.245 | A | 330 | 306 | 17 | 0 | 0 | 3 | [[19, 315]] | 1.0 | 8k5r | CMGC_CDK9_HUMAN | CMGC | 9.7e-80 | 273.9 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| 6Z45A | 5 | 328 | 372.0 | Q6E:401 | Type1 | Inactive | DFGin | 7.317 | 14.744 | BLAminus | -124.48, 171.21 | 57.13, 81.63 | -95.68, 19.28 | 282.63, 77.61 | -65.74, -21.16 | in-in | in | 9.092 | Saltbr-in | 3.441 | HRD-in | -72.24, -47.68 | 66.59, 11.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.824 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -126.93, 143.26 | APE9-dihe-na | 76.68, 135.99 | APE8-dihe-in | -63.34, 144.14 | APE8-rot-out | 73.55 | APE67-dihe-in | -62.15, -25.5 | -46.95, -49.84 | APE12-dist-in | 13.079 | APE11-dist-in | 9.97 | APE10-dist-in | 7.192 | APE9-dist-in | 3.326 | None | TPO186 | TPO186 | XRAY | 3.37 | 0.174 | 0.188 | A | 330 | 314 | 10 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 6z45 | CMGC_CDK9_HUMAN | CMGC | 1e-79 | 273.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
Hover over column headers for tooltip help
| SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CDK9_HUMAN | 3BLQA | P50750 | 7 | 325 | 372.0 | ATP:332 | ATPlike | Active | DFGin | 6.983 | 15.235 | BLAminus | -137.33, 167.71 | 61.72, 82.78 | -101.54, 27.58 | 292.13, 71.79 | -68.35, -20.47 | in-in | in | 9.514 | Saltbr-in | 3.257 | HRD-in | -70.77, -57.41 | 73.91, 6.35 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.85 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.28, 155.2 | APE9-dihe-na | 75.14, 129.25 | APE8-dihe-in | -51.14, 147.2 | APE8-rot-in | 304.68 | APE67-dihe-in | -62.86, -25.73 | -50.2, -49.1 | APE12-dist-in | 13.028 | APE11-dist-in | 11.03 | APE10-dist-in | 6.896 | APE9-dist-in | 3.154 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.174 | 0.234 | A | 331 | 296 | 23 | 0 | 0 | 7 | [[19, 315]] | 1.0 | 3blq | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4IMYC | P50750 | 8 | 330 | 372.0 | AMP:401 | ATPlike | Active | DFGin | 6.789 | 15.123 | BLAminus | -140.61, 175.84 | 60.41, 77.79 | -97.02, 19.01 | 284.69, 80.72 | -68.98, -8.54 | in-in | in | 9.232 | Saltbr-in | 2.833 | HRD-in | -67.68, -50.97 | 65.16, 13.16 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.928 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.81, 161.81 | APE9-dihe-na | 73.71, 135.92 | APE8-dihe-in | -53.34, 141.57 | APE8-rot-in | 294.85 | APE67-dihe-in | -61.16, -25.06 | -47.9, -50.46 | APE12-dist-in | 13.386 | APE11-dist-in | 11.431 | APE10-dist-in | 7.006 | APE9-dist-in | 3.279 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | C | 332 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4IMYE | P50750 | 8 | 330 | 372.0 | AMP:401 | ATPlike | Active | DFGin | 6.794 | 15.112 | BLAminus | -141.41, 175.75 | 59.75, 77.9 | -96.66, 19.65 | 284.44, 80.03 | -69.65, -8.18 | in-in | in | 9.197 | Saltbr-in | 2.816 | HRD-in | -68.02, -51.11 | 68.06, 12.23 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.919 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.97, 161.65 | APE9-dihe-na | 74.14, 135.63 | APE8-dihe-in | -53.23, 140.74 | APE8-rot-in | 294.81 | APE67-dihe-in | -59.86, -25.62 | -47.7, -50.88 | APE12-dist-in | 13.405 | APE11-dist-in | 11.437 | APE10-dist-in | 7.01 | APE9-dist-in | 3.278 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | E | 332 | 314 | 9 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3MIAA | P50750 | 8 | 340 | 372.0 | ANP:352 | ATPlike | Active | DFGin | 6.803 | 15.077 | BLAminus | -137.71, 176.33 | 64.58, 74.97 | -96.55, 26.44 | 284.7, 90.38 | -67.18, -14.54 | in-in | in | 9.313 | Saltbr-in | 2.689 | HRD-in | -70.81, -51.43 | 63.16, 28.9 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.957 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -141.04, 160.49 | APE9-dihe-na | 82.03, 127.94 | APE8-dihe-in | -49.75, 143.51 | APE8-rot-in | 280.63 | APE67-dihe-in | -52.26, -14.47 | -51.96, -57.94 | APE12-dist-in | 13.258 | APE11-dist-in | 11.524 | APE10-dist-in | 6.949 | APE9-dist-in | 3.523 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.219 | 0.287 | A | 351 | 325 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3mia | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 5.1e-80 | 274.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | AF-P50750-K1A | P50750 | 11 | 323 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.804 | 15.165 | BLAminus | -137.37, 173.37 | 64.39, 60.59 | -77.02, 16.85 | 288.83, 77.77 | -62.06, -30.21 | in-in | in | 8.518 | Saltbr-in | 2.709 | HRD-in | -74.93, -50.16 | 64.15, 10.46 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.815 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -118.96, 171.33 | APE9-dihe-na | 63.33, 135.53 | APE8-dihe-in | -59.46, 137.0 | APE8-rot-in | 298.24 | APE67-dihe-in | -65.46, -22.86 | -48.78, -43.32 | APE12-dist-in | 13.072 | APE11-dist-in | 11.321 | APE10-dist-in | 6.647 | APE9-dist-in | 3.332 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 313 | 313 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | AF-P50750-K1 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.3e-80 | 275.4 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | AF-P50750-K3A | P50750 | 11 | 323 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.062 | 14.698 | BLAminus | -139.94, 174.92 | 58.53, 50.7 | -65.37, 20.59 | 281.14, 76.16 | -63.5, -35.02 | in-in | in | 8.8 | Saltbr-in | 2.765 | HRD-in | -75.68, -48.0 | 63.0, 17.28 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.853 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.22, 172.67 | APE9-dihe-na | 61.33, 130.24 | APE8-dihe-in | -58.01, 135.54 | APE8-rot-in | 298.09 | APE67-dihe-in | -65.99, -22.34 | -47.59, -46.0 | APE12-dist-in | 12.586 | APE11-dist-in | 10.571 | APE10-dist-in | 6.205 | APE9-dist-in | 3.367 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 313 | 313 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | AF-P50750-K3 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.3e-80 | 275.4 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4OR5A | P50750 | 8 | 331 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.943 | 14.74 | BLAminus | -124.31, 168.54 | 69.01, 76.04 | -97.31, 28.71 | 289.03, 30.11 | -68.53, -16.51 | in-in | in | 8.982 | Saltbr-in | 2.762 | HRD-in | -69.96, -55.39 | 71.5, 2.58 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.871 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.38, 159.55 | APE9-dihe-na | 76.25, 129.47 | APE8-dihe-in | -55.54, 147.57 | APE8-rot-in | 323.78 | APE67-dihe-in | -55.49, -19.54 | -44.65, -58.02 | APE12-dist-in | 13.144 | APE11-dist-in | 10.903 | APE10-dist-in | 6.784 | APE9-dist-in | 3.212 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.225 | 0.267 | A | 326 | 320 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4or5 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4OR5F | P50750 | 8 | 332 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.668 | 14.98 | BLAminus | -111.52, -176.73 | 51.04, 89.5 | -102.8, 24.68 | 281.6, 71.85 | -49.29, -46.03 | in-in | in | 9.212 | Saltbr-in | 2.608 | HRD-in | -63.05, -54.26 | 62.81, 29.79 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.877 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.12, 165.75 | APE9-dihe-na | 70.73, 135.03 | APE8-dihe-in | -51.7, 151.98 | APE8-rot-in | 310.95 | APE67-dihe-in | -54.55, -10.13 | -58.62, -54.74 | APE12-dist-in | 12.948 | APE11-dist-in | 10.819 | APE10-dist-in | 6.534 | APE9-dist-in | 3.443 | None | TPO186 | TPO186 | XRAY | 2.9 | 0.225 | 0.267 | F | 326 | 325 | 0 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4or5 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 5L1ZA | P50750 | 8 | 330 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.218 | 14.599 | BLAminus | -125.76, -179.91 | 59.3, 75.76 | -100.2, 28.34 | 287.78, 61.41 | -57.18, -56.97 | in-in | in | 8.958 | Saltbr-in | 2.708 | HRD-in | -67.89, -46.91 | 51.73, 43.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.634 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.76, 164.45 | APE9-dihe-na | 64.74, 143.58 | APE8-dihe-in | -57.19, 139.09 | APE8-rot-in | 301.99 | APE67-dihe-in | -68.84, -33.17 | -48.82, -40.87 | APE12-dist-in | 12.93 | APE11-dist-in | 10.747 | APE10-dist-in | 6.633 | APE9-dist-in | 3.47 | None | TPO186 | TPO186 | XRAY | 5.9 | 0.217 | 0.313 | A | 330 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 5l1z | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 6CYTA | P50750 | 8 | 330 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.128 | 14.819 | BLAminus | -145.42, 171.89 | 59.31, 72.76 | -88.66, 18.9 | 282.04, 75.69 | -58.99, -26.1 | in-in | in | 8.749 | Saltbr-in | 3.085 | HRD-in | -78.56, -48.34 | 62.81, 28.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.77 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.32, 170.8 | APE9-dihe-na | 69.6, 130.71 | APE8-dihe-in | -52.14, 135.55 | APE8-rot-in | 303.56 | APE67-dihe-in | -61.47, -34.74 | -50.37, -43.24 | APE12-dist-in | 13.158 | APE11-dist-in | 11.341 | APE10-dist-in | 6.765 | APE9-dist-in | 3.758 | None | TPO186 | TPO186 | XRAY | 3.5 | 0.251 | 0.283 | A | 332 | 319 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 6cyt | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3MI9A | P50750 | 8 | 344 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.217 | 15.083 | BLAminus | -131.5, 175.99 | 56.36, 81.19 | -96.49, 22.86 | 283.32, 81.7 | -61.79, -15.23 | in-in | in | 9.37 | Saltbr-in | 2.661 | HRD-in | -69.68, -51.06 | 64.68, 15.58 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.904 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -134.92, 157.04 | APE9-dihe-na | 77.38, 136.99 | APE8-dihe-in | -56.37, 139.72 | APE8-rot-in | 276.81 | APE67-dihe-in | -58.41, -18.53 | -45.4, -54.86 | APE12-dist-in | 13.481 | APE11-dist-in | 11.309 | APE10-dist-in | 7.271 | APE9-dist-in | 3.269 | None | TPO186 | TPO186 | XRAY | 2.1 | 0.219 | 0.264 | A | 351 | 329 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3mi9 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 5.1e-80 | 274.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4EC8A | P50750 | 6 | 338 | 372.0 | No_ligand | No_ligand | Active | DFGin | 7.021 | 14.71 | BLAminus | -136.31, 174.5 | 61.51, 81.72 | -97.53, 24.16 | 282.28, 73.66 | -54.62, -38.88 | in-in | in | 9.043 | Saltbr-in | 2.941 | HRD-in | -86.88, -43.45 | 62.41, 27.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.86 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -117.08, 171.7 | APE9-dihe-na | 55.16, 133.32 | APE8-dihe-in | -40.35, 153.59 | APE8-rot-in | 304.69 | APE67-dihe-in | -58.26, -42.11 | -57.08, -55.81 | APE12-dist-in | 13.106 | APE11-dist-in | 11.158 | APE10-dist-in | 6.718 | APE9-dist-in | 3.298 | None | TPO186 | TPO186 | XRAY | 3.6 | 0.194 | 0.23 | A | 373 | 326 | 7 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ec8 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 6.3e-80 | 274.7 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4EC9A | P50750 | 7 | 327 | 372.0 | No_ligand | No_ligand | Active | DFGin | 6.963 | 15.031 | BLAminus | -130.28, 170.97 | 63.86, 78.14 | -96.65, 19.21 | 284.99, 81.64 | -66.97, -16.11 | in-in | in | 9.502 | Saltbr-in | 3.167 | HRD-in | -77.71, -44.73 | 68.48, 6.05 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.76 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.99, 139.69 | APE9-dihe-na | 84.51, 133.17 | APE8-dihe-in | -49.64, 141.35 | APE8-rot-in | 313.22 | APE67-dihe-in | -69.04, -23.15 | -49.34, -46.9 | APE12-dist-in | 13.439 | APE11-dist-in | 11.28 | APE10-dist-in | 7.175 | APE9-dist-in | 2.912 | None | TPO186 | TPO186 | XRAY | 3.21 | 0.203 | 0.233 | A | 373 | 307 | 14 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ec9 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 6.3e-80 | 274.7 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4BCFA | P50750 | 6 | 326 | 372.0 | T6Q:1327 | Type1 | Active | DFGin | 7.035 | 15.006 | BLAminus | -130.89, 175.85 | 58.26, 78.19 | -93.84, 20.92 | 284.01, 74.28 | -69.0, -18.91 | in-in | in | 9.385 | Saltbr-in | 3.454 | HRD-in | -78.09, -44.7 | 68.67, 6.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.871 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -125.92, 149.94 | APE9-dihe-na | 81.04, 132.5 | APE8-dihe-in | -49.66, 140.73 | APE8-rot-in | 291.42 | APE67-dihe-in | -67.27, -22.18 | -50.7, -44.79 | APE12-dist-in | 13.104 | APE11-dist-in | 10.304 | APE10-dist-in | 6.907 | APE9-dist-in | 3.128 | None | TPO186 | TPO186 | XRAY | 3.011 | 0.169 | 0.224 | A | 331 | 308 | 13 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 4bcf | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.7e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 8I0LA | P50750 | 6 | 326 | 372.0 | NJ6:401 | Type1 | Active | DFGin | 7.293 | 15.855 | BLAminus | -130.69, 179.52 | 57.03, 69.82 | -94.01, 27.86 | 282.24, 73.6 | -69.08, -49.61 | in-in | in | 9.573 | Saltbr-in | 3.235 | HRD-in | -83.43, -47.61 | 60.01, 23.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.759 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -113.64, 163.64 | APE9-dihe-na | 68.82, 138.39 | APE8-dihe-in | -61.18, 156.44 | APE8-rot-in | 324.35 | APE67-dihe-in | -70.36, -22.43 | -60.05, -41.69 | APE12-dist-in | 12.809 | APE11-dist-in | 10.347 | APE10-dist-in | 6.433 | APE9-dist-in | 3.549 | None | TPO186 | TPO186 | XRAY | 3.6 | 0.235 | 0.257 | A | 332 | 308 | 13 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 8i0l | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.8e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 6GZHA | P50750 | 8 | 326 | 372.0 | LCI:2001 | Type1 | Active | DFGin | 6.962 | 15.276 | BLAminus | -143.64, 171.3 | 50.95, 83.68 | -93.37, 33.37 | 284.73, 74.17 | -64.71, -41.34 | in-in | in | 9.645 | Saltbr-in | 2.886 | HRD-in | -65.68, -54.2 | 64.63, 22.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.772 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -139.77, 163.06 | APE9-dihe-na | 70.11, 142.16 | APE8-dihe-in | -60.75, 137.92 | APE8-rot-in | 300.9 | APE67-dihe-in | -63.71, -23.63 | -48.56, -44.41 | APE12-dist-in | 12.829 | APE11-dist-in | 10.306 | APE10-dist-in | 6.58 | APE9-dist-in | 3.427 | None | TPO186 | TPO186 | XRAY | 3.17 | 0.175 | 0.257 | A | 326 | 310 | 9 | 0 | 0 | 3 | [[19, 315]] | 1.0 | 6gzh | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 3.9e-80 | 275.2 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3LQ5A | P50750 | 6 | 327 | 372.0 | SLQ:331 | Type1 | Active | DFGin | 7.077 | 14.862 | BLAminus | -142.24, 175.94 | 56.62, 82.08 | -95.24, 28.75 | 286.71, 83.42 | -69.95, -28.82 | in-in | in | 9.106 | Saltbr-in | 3.55 | HRD-in | -75.08, -43.56 | 66.05, 12.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.86 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -112.5, 158.49 | APE9-dihe-na | 76.36, 121.96 | APE8-dihe-in | -35.3, 136.84 | APE8-rot-in | 307.0 | APE67-dihe-in | -57.48, -14.79 | -49.62, -56.61 | APE12-dist-in | 13.159 | APE11-dist-in | 10.52 | APE10-dist-in | 6.791 | APE9-dist-in | 3.532 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.165 | 0.215 | A | 331 | 308 | 14 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3lq5 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3MY1A | P50750 | 6 | 327 | 372.0 | RFZ:336 | Type1 | Active | DFGin | 6.92 | 14.737 | BLAminus | -138.6, -178.76 | 55.85, 82.27 | -96.58, 26.19 | 286.18, 71.12 | -65.01, -22.99 | in-in | in | 9.174 | Saltbr-in | 3.024 | HRD-in | -74.76, -49.19 | 65.23, 25.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.771 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -108.34, 163.18 | APE9-dihe-na | 70.44, 131.12 | APE8-dihe-in | -41.78, 152.21 | APE8-rot-in | 296.57 | APE67-dihe-in | -62.52, -36.66 | -60.91, -51.23 | APE12-dist-in | 13.127 | APE11-dist-in | 11.22 | APE10-dist-in | 6.853 | APE9-dist-in | 3.38 | None | TPO186 | TPO186 | XRAY | 2.8 | 0.175 | 0.214 | A | 331 | 315 | 7 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 3my1 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3TN8A | P50750 | 8 | 325 | 372.0 | F18:332 | Type1 | Active | DFGin | 6.928 | 14.758 | BLAminus | -143.85, 178.49 | 57.5, 79.87 | -95.98, 37.06 | 283.24, 76.06 | -66.12, -47.35 | in-in | in | 8.875 | Saltbr-in | 3.079 | HRD-in | -75.16, -50.1 | 67.86, 4.01 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.743 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -105.91, 161.16 | APE9-dihe-na | 76.41, 125.51 | APE8-dihe-in | -47.81, 145.62 | APE8-rot-in | 301.4 | APE67-dihe-in | -65.71, -32.31 | -55.05, -44.31 | APE12-dist-in | 12.863 | APE11-dist-in | 10.197 | APE10-dist-in | 6.704 | APE9-dist-in | 3.197 | None | TPO186 | TPO186 | XRAY | 2.95 | 0.179 | 0.221 | A | 331 | 305 | 13 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3tn8 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3TNHA | P50750 | 8 | 328 | 372.0 | F18:400 | Type1 | Active | DFGin | 6.895 | 14.863 | BLAminus | -133.46, 172.31 | 64.77, 76.91 | -97.39, 20.03 | 283.08, 80.82 | -68.17, -17.73 | in-in | in | 9.065 | Saltbr-in | 3.343 | HRD-in | -75.15, -45.06 | 69.35, 5.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.787 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.95, 145.17 | APE9-dihe-na | 82.57, 129.21 | APE8-dihe-in | -52.21, 142.64 | APE8-rot-in | 282.87 | APE67-dihe-in | -68.26, -22.31 | -48.58, -47.58 | APE12-dist-in | 12.85 | APE11-dist-in | 9.703 | APE10-dist-in | 6.867 | APE9-dist-in | 3.198 | None | TPO186 | TPO186 | XRAY | 3.202 | 0.179 | 0.226 | A | 331 | 289 | 32 | 0 | 0 | 7 | [[19, 315]] | 1.0 | 3tnh | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4OGRA | P50750 | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 6.959 | 14.852 | BLAminus | -145.48, 171.71 | 58.99, 73.11 | -88.05, 19.07 | 282.19, 75.89 | -59.04, -25.77 | in-in | in | 8.622 | Saltbr-in | 3.202 | HRD-in | -78.29, -48.1 | 62.83, 28.93 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.885 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.59, 171.14 | APE9-dihe-na | 70.34, 130.75 | APE8-dihe-in | -51.49, 135.3 | APE8-rot-in | 303.62 | APE67-dihe-in | -61.39, -34.94 | -50.28, -42.94 | APE12-dist-in | 13.245 | APE11-dist-in | 11.482 | APE10-dist-in | 6.706 | APE9-dist-in | 3.205 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | A | 332 | 315 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4OGRE | P50750 | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 7.086 | 14.749 | BLAminus | -145.95, 172.29 | 59.47, 72.14 | -89.89, 19.36 | 283.65, 75.49 | -58.97, -26.2 | in-in | in | 8.801 | Saltbr-in | 2.931 | HRD-in | -77.91, -48.96 | 62.4, 28.78 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.848 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.99, 169.74 | APE9-dihe-na | 65.95, 134.0 | APE8-dihe-in | -52.43, 138.08 | APE8-rot-in | 303.65 | APE67-dihe-in | -62.11, -36.08 | -50.82, -43.72 | APE12-dist-in | 13.214 | APE11-dist-in | 11.177 | APE10-dist-in | 6.799 | APE9-dist-in | 3.429 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | E | 332 | 311 | 12 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4OGRI | P50750 | 8 | 330 | 372.0 | ADN:60401 | Type1 | Active | DFGin | 7.02 | 14.857 | BLAminus | -146.32, 171.3 | 58.62, 73.81 | -88.0, 20.33 | 283.45, 75.93 | -58.21, -25.18 | in-in | in | 8.754 | Saltbr-in | 3.252 | HRD-in | -77.88, -47.68 | 62.44, 29.24 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.937 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.71, 169.37 | APE9-dihe-na | 67.96, 131.32 | APE8-dihe-in | -52.01, 135.85 | APE8-rot-in | 303.33 | APE67-dihe-in | -60.26, -34.97 | -51.39, -42.17 | APE12-dist-in | 13.226 | APE11-dist-in | 11.036 | APE10-dist-in | 6.524 | APE9-dist-in | 3.127 | None | TPO186 | TPO186 | XRAY | 3.0 | 0.206 | 0.232 | I | 332 | 319 | 4 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4ogr | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 6W9EA | P50750 | 7 | 326 | 372.0 | TO7:401,TO7:402,TOJ:403,TOJ:404 | Type1,Type1,Type1,Type1 | Active | DFGin | 7.001 | 15.083 | BLAminus | -134.21, 172.07 | 61.13, 81.04 | -94.79, 28.67 | 292.71, 81.0 | -65.23, -42.38 | in-in | in | 9.226 | Saltbr-in | 3.047 | HRD-in | -77.57, -45.55 | 60.07, 27.0 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.794 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -147.35, 150.83 | APE9-dihe-na | 76.33, 139.44 | APE8-dihe-in | -54.19, 159.88 | APE8-rot-in | 315.27 | APE67-dihe-in | -69.62, -18.61 | -64.18, -47.28 | APE12-dist-in | 12.768 | APE11-dist-in | 10.465 | APE10-dist-in | 6.775 | APE9-dist-in | 3.411 | None | TPO186,SEP306 | TPO186,SEP306 | XRAY | 3.1 | 0.175 | 0.221 | A | 330 | 311 | 9 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 6w9e | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4IMYA | P50750 | 8 | 330 | 372.0 | AMP:401 | Type1.5_Back | Active | DFGin | 6.761 | 15.126 | BLAminus | -140.16, 177.94 | 57.41, 78.2 | -96.63, 19.81 | 285.27, 81.22 | -68.88, -9.41 | in-in | in | 9.227 | Saltbr-in | 2.849 | HRD-in | -67.2, -51.3 | 65.19, 13.63 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.92 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.99, 161.25 | APE9-dihe-na | 74.17, 135.57 | APE8-dihe-in | -52.35, 140.79 | APE8-rot-in | 295.69 | APE67-dihe-in | -60.8, -24.95 | -48.08, -50.31 | APE12-dist-in | 13.39 | APE11-dist-in | 11.433 | APE10-dist-in | 7.009 | APE9-dist-in | 3.27 | None | TPO186 | TPO186 | XRAY | 2.94 | 0.209 | 0.245 | A | 332 | 315 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4imy | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3BLHA | P50750 | 8 | 325 | 372.0 | No_ligand | No_ligand | Inactive | DFGin | 7.105 | 15.617 | BLAminus | -129.9, 170.98 | 63.01, 77.18 | -97.75, 18.52 | 284.97, 81.6 | -67.67, -17.09 | in-out | in | 9.598 | Saltbr-out | 5.608 | HRD-in | -77.19, -44.8 | 68.26, 4.38 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -126.83, 136.54 | APE9-dihe-na | 82.17, 131.77 | APE8-dihe-in | -51.9, 141.65 | APE8-rot-in | 281.88 | APE67-dihe-in | -68.04, -21.93 | -48.78, -46.05 | APE12-dist-in | 13.097 | APE11-dist-in | 9.69 | APE10-dist-in | 7.388 | APE9-dist-in | 3.169 | None | TPO186 | TPO186 | XRAY | 2.48 | 0.179 | 0.221 | A | 331 | 292 | 26 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 3blh | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3TNIA | P50750 | 7 | 325 | 372.0 | No_ligand | No_ligand | Inactive | DFGin | 6.96 | 15.518 | BLAminus | -129.67, 172.05 | 64.93, 76.48 | -99.12, 16.83 | 286.41, 84.44 | -68.12, -14.55 | in-out | in | 9.812 | Saltbr-out | 6.519 | HRD-in | -78.02, -45.15 | 68.07, 5.47 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.828 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.05, 143.65 | APE9-dihe-na | 85.09, 131.61 | APE8-dihe-in | -49.91, 142.7 | APE8-rot-in | 287.18 | APE67-dihe-in | -68.03, -22.83 | -48.7, -45.44 | APE12-dist-in | 13.389 | APE11-dist-in | 11.096 | APE10-dist-in | 7.265 | APE9-dist-in | 3.245 | None | TPO186 | TPO186 | XRAY | 3.234 | 0.166 | 0.21 | A | 331 | 298 | 21 | 0 | 0 | 6 | [[19, 315]] | 1.0 | 3tni | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 7NWKA | P50750 | 7 | 326 | 372.0 | UT5:401 | Type1 | Inactive | DFGin | 7.111 | 14.991 | BLAminus | -124.85, 176.65 | 53.29, 84.25 | -99.42, 22.06 | 284.43, 78.88 | -62.72, -24.1 | in-in | in | 9.188 | Saltbr-in | 3.356 | HRD-in | -72.75, -46.7 | 63.63, 12.3 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.819 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -125.99, 150.18 | APE9-dihe-na | 74.8, 134.0 | APE8-dihe-in | -57.76, 142.58 | APE8-rot-out | 9.44 | APE67-dihe-in | -60.65, -26.29 | -46.55, -51.52 | APE12-dist-in | 12.915 | APE11-dist-in | 10.299 | APE10-dist-in | 6.828 | APE9-dist-in | 3.36 | None | TPO186 | TPO186 | XRAY | 2.81 | 0.182 | 0.205 | A | 330 | 298 | 22 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 7nwk | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 3BLRA | P50750 | 7 | 326 | 372.0 | CPB:940 | Type1 | Inactive | DFGin | 6.849 | 14.983 | BLAminus | -137.81, 169.59 | 65.05, 86.98 | -102.47, 22.09 | 282.73, 80.55 | -59.33, -27.76 | in-in | in | 9.73 | Saltbr-in | 3.0 | HRD-in | -77.6, -52.79 | 69.15, 9.31 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.838 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -123.25, 157.8 | APE9-dihe-na | 74.85, 130.66 | APE8-dihe-in | -57.24, 143.32 | APE8-rot-out | 21.76 | APE67-dihe-in | -65.59, -31.38 | -41.87, -49.24 | APE12-dist-in | 13.189 | APE11-dist-in | 10.838 | APE10-dist-in | 6.85 | APE9-dist-in | 3.362 | None | TPO186 | TPO186 | XRAY | 2.8 | 0.176 | 0.228 | A | 331 | 301 | 19 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 3blr | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4BCGA | P50750 | 7 | 327 | 372.0 | T3C:1328 | Type1 | Inactive | DFGin | 7.134 | 15.244 | BLAminus | -132.48, 173.97 | 58.32, 78.23 | -93.26, 24.05 | 284.24, 75.68 | -68.96, -23.34 | in-out | in | 9.462 | Saltbr-out | 4.647 | HRD-in | -78.18, -44.27 | 68.6, 10.18 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.878 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -128.1, 147.31 | APE9-dihe-na | 81.87, 132.15 | APE8-dihe-in | -51.72, 141.44 | APE8-rot-in | 291.43 | APE67-dihe-in | -63.63, -25.74 | -50.67, -46.04 | APE12-dist-in | 13.109 | APE11-dist-in | 10.231 | APE10-dist-in | 6.933 | APE9-dist-in | 3.179 | None | TPO186 | TPO186 | XRAY | 3.085 | 0.163 | 0.197 | A | 331 | 313 | 8 | 0 | 0 | 0 | [[19, 315]] | 1.0 | 4bcg | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4BCHA | P50750 | 7 | 327 | 372.0 | T7Z:1328 | Type1 | Inactive | DFGin | 7.022 | 15.251 | BLAminus | -131.52, 173.1 | 62.62, 79.06 | -97.34, 18.94 | 284.72, 72.84 | -65.45, -18.12 | in-out | in | 9.564 | Saltbr-out | 4.337 | HRD-in | -78.74, -44.37 | 68.53, 5.43 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.917 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -98.64, 156.76 | APE9-dihe-na | 81.03, 133.91 | APE8-dihe-in | -51.15, 142.4 | APE8-rot-in | 295.91 | APE67-dihe-in | -66.84, -22.68 | -48.59, -47.41 | APE12-dist-in | 13.267 | APE11-dist-in | 10.899 | APE10-dist-in | 6.912 | APE9-dist-in | 3.181 | None | TPO186 | TPO186 | XRAY | 2.958 | 0.169 | 0.21 | A | 331 | 309 | 12 | 0 | 0 | 5 | [[19, 315]] | 1.0 | 4bch | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4BCIA | P50750 | 5 | 326 | 372.0 | T3E:1327 | Type1 | Inactive | DFGin | 7.099 | 15.182 | BLAminus | -131.07, 172.91 | 63.16, 77.79 | -97.71, 24.25 | 283.9, 77.6 | -66.92, -23.58 | in-out | in | 9.472 | Saltbr-out | 4.196 | HRD-in | -77.09, -44.37 | 66.65, 15.51 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -105.81, 155.45 | APE9-dihe-na | 82.12, 132.8 | APE8-dihe-in | -46.04, 142.98 | APE8-rot-in | 310.28 | APE67-dihe-in | -70.86, -24.72 | -49.47, -47.11 | APE12-dist-in | 13.101 | APE11-dist-in | 11.156 | APE10-dist-in | 6.828 | APE9-dist-in | 3.348 | None | TPO186 | TPO186 | XRAY | 3.1 | 0.18 | 0.221 | A | 331 | 309 | 13 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 4bci | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 4BCJA | P50750 | 6 | 326 | 372.0 | T9N:1327 | Type1 | Inactive | DFGin | 7.03 | 15.018 | BLAminus | -131.0, 170.86 | 63.37, 81.25 | -96.53, 22.01 | 287.4, 63.38 | -57.12, -37.16 | in-out | in | 9.444 | Saltbr-out | 4.455 | HRD-in | -79.62, -45.57 | 66.85, 8.76 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.873 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -113.55, 158.16 | APE9-dihe-na | 80.36, 134.65 | APE8-dihe-in | -47.14, 141.93 | APE8-rot-in | 299.93 | APE67-dihe-in | -67.12, -25.13 | -50.6, -47.83 | APE12-dist-in | 13.096 | APE11-dist-in | 11.108 | APE10-dist-in | 6.84 | APE9-dist-in | 3.158 | None | TPO186 | TPO186 | XRAY | 3.162 | 0.162 | 0.207 | A | 331 | 310 | 11 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 4bcj | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 4.1e-80 | 275.1 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 8K5RA | P50750 | 5 | 327 | 372.0 | VQE:401 | Type1 | Inactive | DFGin | 7.543 | 15.463 | BLAminus | -127.7, -178.83 | 57.51, 52.57 | -82.11, 20.94 | 280.63, 64.24 | -61.34, -43.86 | in-out | in | 9.292 | Saltbr-out | 3.716 | HRD-in | -86.18, -55.67 | 72.35, 16.43 | out-in-in | SNCoii | in-in | ActLoopNT-in | 2.709 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.28, 166.1 | APE9-dihe-na | 82.22, 165.84 | APE8-dihe-in | -71.04, 149.98 | APE8-rot-in | 312.55 | APE67-dihe-in | -65.92, -42.72 | -67.97, -33.99 | APE12-dist-in | 12.916 | APE11-dist-in | 11.442 | APE10-dist-in | 6.819 | APE9-dist-in | 3.164 | S7D,V8N,K44R,Y138F,K280A,D307E,N311E | TPO186 | TPO186 | XRAY | 3.751 | 0.203 | 0.245 | A | 330 | 306 | 17 | 0 | 0 | 3 | [[19, 315]] | 1.0 | 8k5r | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 9.7e-80 | 273.9 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| CDK9_HUMAN | 6Z45A | P50750 | 5 | 328 | 372.0 | Q6E:401 | Type1 | Inactive | DFGin | 7.317 | 14.744 | BLAminus | -124.48, 171.21 | 57.13, 81.63 | -95.68, 19.28 | 282.63, 77.61 | -65.74, -21.16 | in-in | in | 9.092 | Saltbr-in | 3.441 | HRD-in | -72.24, -47.68 | 66.59, 11.95 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.824 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -126.93, 143.26 | APE9-dihe-na | 76.68, 135.99 | APE8-dihe-in | -63.34, 144.14 | APE8-rot-out | 73.55 | APE67-dihe-in | -62.15, -25.5 | -46.95, -49.84 | APE12-dist-in | 13.079 | APE11-dist-in | 9.97 | APE10-dist-in | 7.192 | APE9-dist-in | 3.326 | None | TPO186 | TPO186 | XRAY | 3.37 | 0.174 | 0.188 | A | 330 | 314 | 10 | 0 | 0 | 4 | [[19, 315]] | 1.0 | 6z45 | Homo sapiens | CMGC_CDK9_HUMAN | CMGC | 1e-79 | 273.8 | 1 | 301 | 301 | 166 | 167 | 168 | 170 | 172 | 48 | 66 | 70 | 146 | 148 | 147 | 149 | 211 | 198 | 193 | 192 | 191 | 190 | 189 | 188 | 187 | 104 | Cyclin-dependent kinase 9 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
Hover over column headers for tooltip help
| SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|