| Gene | 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 | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CDK5 | 1H4LA | Q00535 | 2 | 287 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.6202 | 15.4792 | BLAminus | -143.56, 176.2 | 53.14, 75.93 | -87.23, 17.57 | 281.42, 66.7 | -52.55, -28.59 | in-in | in | 8.8095 | Saltbr-in | 3.2322 | HRD-in | -81.11, -48.22 | 60.62, 20.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0091 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.33, 150.77 | APE9-dihe-na | 67.7, 126.9 | APE8-dihe-in | -54.75, 150.37 | APE8-rot-in | 308.87 | APE67-dihe-in | -61.52, -7.78 | -40.44, -61.3 | APE12-dist-in | 12.9199 | APE11-dist-in | 9.7497 | APE10-dist-in | 6.6944 | APE9-dist-in | 3.2531 | None | None | None | XRAY | 2.65 | 0.236 | 0.287 | A | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h4l | CMGC_CDK5_HUMAN | CMGC | 7.3e-84 | 288.0 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1H4LB | Q00535 | 2 | 287 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.6592 | 15.4399 | BLAminus | -143.33, -179.13 | 52.72, 73.32 | -87.36, 23.9 | 283.69, 63.17 | -58.01, -24.27 | in-in | in | 8.934 | Saltbr-in | 3.125 | HRD-in | -84.82, -44.08 | 59.2, 10.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.013 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.96, 143.89 | APE9-dihe-na | 72.68, 133.7 | APE8-dihe-in | -61.48, 143.63 | APE8-rot-in | 309.63 | APE67-dihe-in | -61.01, -6.73 | -35.26, -57.65 | APE12-dist-in | 12.7648 | APE11-dist-in | 9.5823 | APE10-dist-in | 6.522 | APE9-dist-in | 3.1447 | None | None | None | XRAY | 2.65 | 0.236 | 0.287 | B | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h4l | CMGC_CDK5_HUMAN | CMGC | 7.3e-84 | 288.0 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | AF-Q00535-K1A | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.8121 | 15.0795 | BLAminus | -137.71, 176.76 | 52.72, 65.61 | -76.52, 17.03 | 281.04, 72.01 | -63.52, -30.68 | in-in | in | 8.8174 | Saltbr-in | 2.7367 | HRD-in | -77.47, -45.4 | 62.19, 14.23 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8666 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.25, 162.61 | APE9-dihe-na | 62.11, 128.26 | APE8-dihe-in | -54.35, 135.75 | APE8-rot-in | 298.8 | APE67-dihe-in | -65.0, -24.32 | -44.79, -46.3 | APE12-dist-in | 13.2835 | APE11-dist-in | 10.4527 | APE10-dist-in | 6.8641 | APE9-dist-in | 3.2781 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | AF-Q00535-K1 | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | AF-Q00535-K3A | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.7214 | 14.9428 | BLAminus | -139.19, 173.54 | 59.01, 63.04 | -76.77, 15.26 | 281.96, 72.04 | -59.74, -32.22 | in-in | in | 8.9267 | Saltbr-in | 2.821 | HRD-in | -77.38, -51.01 | 62.6, 14.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8423 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.79, 159.19 | APE9-dihe-na | 60.88, 136.97 | APE8-dihe-in | -57.12, 135.78 | APE8-rot-in | 296.35 | APE67-dihe-in | -65.12, -22.17 | -41.34, -44.93 | APE12-dist-in | 13.0008 | APE11-dist-in | 10.5199 | APE10-dist-in | 6.701 | APE9-dist-in | 3.61 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | AF-Q00535-K3 | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDSB | Q00535 | 3 | 288 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.2538 | 15.0864 | BLAminus | -137.57, 174.05 | 68.25, 91.71 | -107.27, 29.03 | 281.77, 31.22 | -63.82, -33.82 | in-in | in | 8.8344 | Saltbr-in | 3.0003 | HRD-in | -79.36, -55.2 | 68.82, 21.54 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8349 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.32, 150.53 | APE9-dihe-na | 76.98, 135.45 | APE8-dihe-in | -57.6, 129.9 | APE8-rot-in | 306.14 | APE67-dihe-in | -71.32, -21.13 | -39.47, -39.34 | APE12-dist-in | 12.6886 | APE11-dist-in | 9.9312 | APE10-dist-in | 6.2877 | APE9-dist-in | 3.4263 | None | None | None | XRAY | 3.05 | 0.228 | 0.272 | B | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vds | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNLB | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.886 | 14.8508 | BLAminus | -135.82, 173.41 | 59.96, 81.07 | -98.2, 33.32 | 283.07, 69.38 | -75.63, -27.28 | in-in | in | 8.4516 | Saltbr-in | 3.158 | HRD-in | -77.91, -53.06 | 63.81, 22.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0044 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.88, 159.89 | APE9-dihe-na | 67.72, 132.78 | APE8-dihe-in | -56.55, 142.64 | APE8-rot-in | 295.52 | APE67-dihe-in | -68.05, -20.23 | -51.27, -43.49 | APE12-dist-in | 12.8777 | APE11-dist-in | 10.1756 | APE10-dist-in | 6.3904 | APE9-dist-in | 3.2178 | D144N | None | None | XRAY | 2.2 | 0.216 | 0.219 | B | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unl | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 3O0GA | Q00535 | 1 | 289 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.8294 | 15.2178 | BLAminus | -136.42, 175.77 | 61.32, 76.52 | -94.77, 26.39 | 279.12, 71.78 | -74.78, -15.11 | in-in | in | 8.7244 | Saltbr-in | 2.5526 | HRD-in | -79.72, -52.16 | 68.31, 13.14 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9154 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.07, 157.29 | APE9-dihe-na | 70.83, 127.92 | APE8-dihe-in | -52.36, 134.76 | APE8-rot-in | 293.6 | APE67-dihe-in | -63.53, -19.46 | -44.63, -48.78 | APE12-dist-in | 13.4692 | APE11-dist-in | 10.7286 | APE10-dist-in | 6.966 | APE9-dist-in | 3.2718 | D144N | None | None | XRAY | 1.95 | 0.228 | 0.256 | A | 292.0 | 289.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3o0g | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNGA | Q00535 | 1 | 292 | 292.0 | ALH:1293 | Type1 | Active | DFGin | 6.8038 | 15.5082 | BLAminus | -133.26, 177.58 | 62.73, 72.63 | -89.91, 24.29 | 283.27, 66.96 | -66.0, -18.39 | in-in | in | 8.9632 | Saltbr-in | 2.6515 | HRD-in | -78.57, -49.35 | 66.52, 4.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7567 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.0, 143.2 | APE9-dihe-na | 84.58, 125.12 | APE8-dihe-in | -53.58, 144.18 | APE8-rot-in | 305.47 | APE67-dihe-in | -64.4, -16.61 | -47.26, -45.44 | APE12-dist-in | 13.7754 | APE11-dist-in | 10.8356 | APE10-dist-in | 7.0066 | APE9-dist-in | 3.4894 | D144N | None | None | XRAY | 2.3 | 0.216 | 0.225 | A | 292.0 | 288.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1ung | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNGB | Q00535 | 2 | 288 | 292.0 | ALH:1288 | Type1 | Active | DFGin | 6.7562 | 15.2398 | BLAminus | -135.97, 174.05 | 60.46, 78.03 | -103.9, 21.9 | 274.8, 75.17 | -65.02, -29.35 | in-in | in | 9.083 | Saltbr-in | 2.6574 | HRD-in | -79.66, -50.24 | 62.45, 11.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0431 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -136.0, 151.25 | APE9-dihe-na | 73.87, 134.42 | APE8-dihe-in | -67.73, 142.85 | APE8-rot-in | 304.57 | APE67-dihe-in | -65.69, -18.42 | -33.73, -53.69 | APE12-dist-in | 12.9582 | APE11-dist-in | 9.5843 | APE10-dist-in | 6.5108 | APE9-dist-in | 3.3065 | D144N | None | None | XRAY | 2.3 | 0.216 | 0.225 | B | 292.0 | 269.0 | 18 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1ung | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNHA | Q00535 | 2 | 288 | 292.0 | IXM:1288 | Type1 | Active | DFGin | 6.7757 | 15.0921 | BLAminus | -140.41, 176.0 | 60.42, 76.79 | -95.69, 24.18 | 281.89, 69.34 | -62.09, -29.91 | in-in | in | 8.6743 | Saltbr-in | 2.9932 | HRD-in | -79.64, -52.48 | 66.83, 20.74 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8414 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.37, 151.6 | APE9-dihe-na | 72.7, 127.61 | APE8-dihe-in | -51.97, 137.86 | APE8-rot-in | 307.6 | APE67-dihe-in | -65.83, -14.98 | -38.09, -55.48 | APE12-dist-in | 13.0995 | APE11-dist-in | 9.8991 | APE10-dist-in | 6.9004 | APE9-dist-in | 3.3457 | D144N | None | None | XRAY | 2.35 | 0.229 | 0.23 | A | 292.0 | 277.0 | 10 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unh | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNHB | Q00535 | 2 | 288 | 292.0 | IXM:1288 | Type1 | Active | DFGin | 6.8388 | 15.1453 | BLAminus | -141.38, 178.67 | 60.42, 76.27 | -98.32, 21.68 | 277.9, 76.2 | -63.97, -22.06 | in-in | in | 8.6349 | Saltbr-in | 3.2558 | HRD-in | -75.22, -55.65 | 69.38, 16.95 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8267 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.18, 147.66 | APE9-dihe-na | 73.19, 127.24 | APE8-dihe-in | -46.64, 135.38 | APE8-rot-in | 297.76 | APE67-dihe-in | -66.71, -15.92 | -39.6, -54.16 | APE12-dist-in | 13.1463 | APE11-dist-in | 9.9739 | APE10-dist-in | 7.0516 | APE9-dist-in | 3.3187 | D144N | None | None | XRAY | 2.35 | 0.229 | 0.23 | B | 292.0 | 277.0 | 10 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unh | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 1UNLA | Q00535 | 1 | 292 | 292.0 | RRC:1293 | Type1 | Active | DFGin | 6.8293 | 15.2016 | BLAminus | -128.33, 173.21 | 66.87, 81.02 | -97.91, 23.56 | 283.17, 72.64 | -73.67, -20.59 | in-in | in | 8.3091 | Saltbr-in | 2.8471 | HRD-in | -82.56, -50.74 | 69.72, 10.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9193 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.08, 156.73 | APE9-dihe-na | 71.89, 126.73 | APE8-dihe-in | -48.26, 136.09 | APE8-rot-in | 296.72 | APE67-dihe-in | -59.67, -21.67 | -44.15, -47.77 | APE12-dist-in | 13.5586 | APE11-dist-in | 10.7803 | APE10-dist-in | 7.1047 | APE9-dist-in | 3.2635 | D144N | None | None | XRAY | 2.2 | 0.216 | 0.219 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unl | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 3O0GB | Q00535 | 6 | 288 | 292.0 | 3O0:293 | Type1 | Active | DFGin | 6.923 | 14.7947 | BLAminus | -129.48, 175.97 | 62.66, 84.26 | -100.98, 30.43 | 284.37, 72.05 | -63.02, -27.78 | in-in | in | 8.8214 | Saltbr-in | 2.7631 | HRD-in | -83.72, -54.01 | 67.99, 17.3 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8557 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.49, 157.23 | APE9-dihe-na | 72.19, 128.42 | APE8-dihe-in | -53.83, 140.52 | APE8-rot-in | 308.29 | APE67-dihe-in | -61.77, -21.68 | -45.86, -49.86 | APE12-dist-in | 12.7273 | APE11-dist-in | 9.9091 | APE10-dist-in | 6.3251 | APE9-dist-in | 3.248 | D144N | None | None | XRAY | 1.95 | 0.228 | 0.256 | B | 292.0 | 264.0 | 21 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3o0g | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDPA | Q00535 | 2 | 291 | 292.0 | 65L:301 | Type1 | Inactive | DFGin | 6.7648 | 15.3893 | BLAminus | -127.42, 170.52 | 67.24, 87.09 | -100.87, 23.21 | 283.17, 74.31 | -63.43, -25.09 | in-out | in | 8.8533 | Saltbr-out | 3.7283 | HRD-in | -78.41, -56.12 | 72.29, 8.93 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8658 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -134.29, 146.94 | APE9-dihe-na | 69.86, 130.59 | APE8-dihe-in | -56.21, 145.09 | APE8-rot-out | 66.15 | APE67-dihe-in | -65.94, -20.99 | -45.11, -46.74 | APE12-dist-in | 13.3218 | APE11-dist-in | 10.197 | APE10-dist-in | 6.9249 | APE9-dist-in | 3.3917 | None | None | None | XRAY | 2.09 | 0.202 | 0.229 | A | 292.0 | 287.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdp | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDPB | Q00535 | 3 | 288 | 292.0 | 65L:301 | Type1 | Inactive | DFGin | 6.7292 | 14.9863 | BLAminus | -127.65, 169.87 | 66.53, 89.09 | -101.2, 27.01 | 283.91, 72.42 | -67.19, -23.91 | in-out | in | 8.8191 | Saltbr-out | 3.7073 | HRD-in | -80.8, -59.5 | 69.85, 17.04 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8868 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -137.89, 151.46 | APE9-dihe-na | 71.79, 133.86 | APE8-dihe-in | -61.46, 147.21 | APE8-rot-out | 65.8 | APE67-dihe-in | -67.63, -21.22 | -46.93, -48.84 | APE12-dist-in | 12.798 | APE11-dist-in | 9.6021 | APE10-dist-in | 6.4704 | APE9-dist-in | 3.3707 | None | None | None | XRAY | 2.09 | 0.202 | 0.229 | B | 292.0 | 279.0 | 7 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdp | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDQA | Q00535 | 2 | 291 | 292.0 | 64V:301 | Type1 | Inactive | DFGin | 6.6062 | 15.2883 | BLAminus | -126.33, 172.99 | 66.95, 84.9 | -102.8, 32.89 | 288.52, 70.91 | -63.45, -40.23 | in-in | in | 8.7668 | Saltbr-in | 2.9151 | HRD-in | -78.08, -59.02 | 67.94, 17.12 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8528 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -140.03, 142.95 | APE9-dihe-na | 72.97, 131.4 | APE8-dihe-in | -63.75, 141.79 | APE8-rot-out | 59.38 | APE67-dihe-in | -67.5, -17.15 | -39.1, -48.99 | APE12-dist-in | 13.3265 | APE11-dist-in | 10.4562 | APE10-dist-in | 6.9809 | APE9-dist-in | 3.343 | None | None | None | XRAY | 2.91 | 0.254 | 0.284 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdq | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDQB | Q00535 | 3 | 288 | 292.0 | 64V:301 | Type1 | Inactive | DFGin | 6.7029 | 15.3713 | BLAminus | -126.83, 173.21 | 67.53, 85.45 | -103.83, 35.8 | 289.7, 71.3 | -66.2, -38.73 | in-in | in | 8.902 | Saltbr-in | 2.9093 | HRD-in | -79.53, -57.9 | 70.89, 16.51 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8736 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -139.15, 143.9 | APE9-dihe-na | 74.88, 143.9 | APE8-dihe-in | -77.64, 140.07 | APE8-rot-out | 62.74 | APE67-dihe-in | -67.14, -19.69 | -37.77, -52.43 | APE12-dist-in | 12.7444 | APE11-dist-in | 9.9205 | APE10-dist-in | 6.6672 | APE9-dist-in | 3.3445 | None | None | None | XRAY | 2.91 | 0.254 | 0.284 | B | 292.0 | 277.0 | 9 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdq | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDRA | Q00535 | 2 | 291 | 292.0 | 63I:301 | Type1 | Inactive | DFGin | 6.6266 | 15.74 | BLAminus | -129.05, 171.62 | 69.47, 86.46 | -104.09, 25.41 | 283.64, 74.23 | -68.34, -21.06 | in-in | in | 8.8803 | Saltbr-in | 3.314 | HRD-in | -78.35, -59.52 | 73.04, 14.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8632 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -137.3, 138.66 | APE9-dihe-na | 71.75, 135.69 | APE8-dihe-in | -66.11, 146.84 | APE8-rot-out | 71.82 | APE67-dihe-in | -69.63, -20.89 | -44.06, -44.5 | APE12-dist-in | 13.0087 | APE11-dist-in | 9.9559 | APE10-dist-in | 6.9609 | APE9-dist-in | 3.3204 | None | None | None | XRAY | 2.55 | 0.221 | 0.256 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdr | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDRB | Q00535 | 3 | 288 | 292.0 | 63I:301 | Type1 | Inactive | DFGin | 6.5755 | 15.3317 | BLAminus | -129.35, 171.52 | 69.7, 87.29 | -105.48, 25.0 | 285.38, 76.15 | -68.91, -20.79 | in-in | in | 8.8894 | Saltbr-in | 3.2949 | HRD-in | -80.02, -61.31 | 72.56, 17.73 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8656 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -136.41, 145.43 | APE9-dihe-na | 74.65, 138.0 | APE8-dihe-in | -69.3, 148.16 | APE8-rot-out | 71.5 | APE67-dihe-in | -71.13, -20.44 | -45.23, -46.82 | APE12-dist-in | 12.9322 | APE11-dist-in | 9.9297 | APE10-dist-in | 6.82 | APE9-dist-in | 3.3178 | None | None | None | XRAY | 2.55 | 0.221 | 0.256 | B | 292.0 | 275.0 | 11 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdr | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 7VDSA | Q00535 | 2 | 291 | 292.0 | 61U:301 | Type1 | Inactive | DFGin | 6.5205 | 15.3292 | BLAminus | -137.7, 177.02 | 65.97, 88.94 | -109.08, 27.6 | 287.56, 67.14 | -63.86, -33.05 | in-in | in | 8.6242 | Saltbr-in | 3.3531 | HRD-in | -79.29, -55.01 | 68.82, 18.0 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8448 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -138.28, 148.16 | APE9-dihe-na | 77.03, 134.42 | APE8-dihe-in | -61.09, 132.18 | APE8-rot-out | 39.92 | APE67-dihe-in | -70.87, -20.07 | -38.56, -38.27 | APE12-dist-in | 13.1199 | APE11-dist-in | 10.3195 | APE10-dist-in | 6.5539 | APE9-dist-in | 3.394 | None | None | None | XRAY | 3.05 | 0.228 | 0.272 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vds | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 4AU8A | Q00535 | 2 | 289 | 292.0 | Z3R:61293 | Type1 | Inactive | DFGin | 7.1122 | 15.1372 | BLAminus | -135.37, 172.87 | 64.95, 77.01 | -97.51, 18.8 | 282.03, 77.47 | -65.91, -19.1 | in-in | in | 8.2084 | Saltbr-in | 2.6454 | HRD-in | -73.52, -48.92 | 73.07, -7.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9444 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -144.11, 169.24 | APE9-dihe-na | -57.47, 146.77 | APE8-dihe-in | -51.22, 149.12 | APE8-rot-out | 191.34 | APE67-dihe-in | -62.35, -21.28 | -39.22, -50.79 | APE12-dist-in | 12.0461 | APE11-dist-out | 6.6974 | APE10-dist-out | 8.6457 | APE9-dist-in | 3.8759 | None | None | None | XRAY | 1.9 | 0.197 | 0.234 | A | 296.0 | 274.0 | 14 | 28 | 26 | 2 | [[4, 286]] | 1.0 | 4au8 | CMGC_CDK5_HUMAN | CMGC | 4.2e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | 4AU8B | Q00535 | 2 | 289 | 292.0 | Z3R:61293 | Type1 | Inactive | DFGin | 7.2608 | 15.5319 | BLAminus | -136.24, 169.41 | 66.3, 80.09 | -99.68, 21.4 | 281.94, 79.2 | -66.25, -19.98 | in-in | in | 8.1283 | Saltbr-in | 2.8349 | HRD-in | -70.21, -48.16 | 75.6, -7.91 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.947 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoi | APE10-dihe-na | 999.0, 152.31 | APE9-dihe-na | -57.56, 146.64 | APE8-dihe-in | -53.33, 139.32 | APE8-rot-out | 196.17 | APE67-dihe-in | -60.73, -25.67 | -36.04, -48.68 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.8336 | APE9-dist-in | 3.8301 | None | None | None | XRAY | 1.9 | 0.197 | 0.234 | B | 296.0 | 277.0 | 11 | 28 | 22 | 6 | [[4, 286]] | 1.0 | 4au8 | CMGC_CDK5_HUMAN | CMGC | 4.2e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| Gene | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CDK5 | CDK5_HUMAN | 1H4LA | Q00535 | 2 | 287 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.6202 | 15.4792 | BLAminus | -143.56, 176.2 | 53.14, 75.93 | -87.23, 17.57 | 281.42, 66.7 | -52.55, -28.59 | in-in | in | 8.8095 | Saltbr-in | 3.2322 | HRD-in | -81.11, -48.22 | 60.62, 20.26 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0091 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -124.33, 150.77 | APE9-dihe-na | 67.7, 126.9 | APE8-dihe-in | -54.75, 150.37 | APE8-rot-in | 308.87 | APE67-dihe-in | -61.52, -7.78 | -40.44, -61.3 | APE12-dist-in | 12.9199 | APE11-dist-in | 9.7497 | APE10-dist-in | 6.6944 | APE9-dist-in | 3.2531 | None | None | None | XRAY | 2.65 | 0.236 | 0.287 | A | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h4l | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 7.3e-84 | 288.0 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1H4LB | Q00535 | 2 | 287 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.6592 | 15.4399 | BLAminus | -143.33, -179.13 | 52.72, 73.32 | -87.36, 23.9 | 283.69, 63.17 | -58.01, -24.27 | in-in | in | 8.934 | Saltbr-in | 3.125 | HRD-in | -84.82, -44.08 | 59.2, 10.17 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.013 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -127.96, 143.89 | APE9-dihe-na | 72.68, 133.7 | APE8-dihe-in | -61.48, 143.63 | APE8-rot-in | 309.63 | APE67-dihe-in | -61.01, -6.73 | -35.26, -57.65 | APE12-dist-in | 12.7648 | APE11-dist-in | 9.5823 | APE10-dist-in | 6.522 | APE9-dist-in | 3.1447 | None | None | None | XRAY | 2.65 | 0.236 | 0.287 | B | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1h4l | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 7.3e-84 | 288.0 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | AF-Q00535-K1A | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.8121 | 15.0795 | BLAminus | -137.71, 176.76 | 52.72, 65.61 | -76.52, 17.03 | 281.04, 72.01 | -63.52, -30.68 | in-in | in | 8.8174 | Saltbr-in | 2.7367 | HRD-in | -77.47, -45.4 | 62.19, 14.23 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8666 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.25, 162.61 | APE9-dihe-na | 62.11, 128.26 | APE8-dihe-in | -54.35, 135.75 | APE8-rot-in | 298.8 | APE67-dihe-in | -65.0, -24.32 | -44.79, -46.3 | APE12-dist-in | 13.2835 | APE11-dist-in | 10.4527 | APE10-dist-in | 6.8641 | APE9-dist-in | 3.2781 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | AF-Q00535-K1 | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | AF-Q00535-K3A | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.7214 | 14.9428 | BLAminus | -139.19, 173.54 | 59.01, 63.04 | -76.77, 15.26 | 281.96, 72.04 | -59.74, -32.22 | in-in | in | 8.9267 | Saltbr-in | 2.821 | HRD-in | -77.38, -51.01 | 62.6, 14.42 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8423 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -129.79, 159.19 | APE9-dihe-na | 60.88, 136.97 | APE8-dihe-in | -57.12, 135.78 | APE8-rot-in | 296.35 | APE67-dihe-in | -65.12, -22.17 | -41.34, -44.93 | APE12-dist-in | 13.0008 | APE11-dist-in | 10.5199 | APE10-dist-in | 6.701 | APE9-dist-in | 3.61 | None | None | None | AF2 | -1.0 | 1.0 | 1.0 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | AF-Q00535-K3 | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDSB | Q00535 | 3 | 288 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.2538 | 15.0864 | BLAminus | -137.57, 174.05 | 68.25, 91.71 | -107.27, 29.03 | 281.77, 31.22 | -63.82, -33.82 | in-in | in | 8.8344 | Saltbr-in | 3.0003 | HRD-in | -79.36, -55.2 | 68.82, 21.54 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8349 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -142.32, 150.53 | APE9-dihe-na | 76.98, 135.45 | APE8-dihe-in | -57.6, 129.9 | APE8-rot-in | 306.14 | APE67-dihe-in | -71.32, -21.13 | -39.47, -39.34 | APE12-dist-in | 12.6886 | APE11-dist-in | 9.9312 | APE10-dist-in | 6.2877 | APE9-dist-in | 3.4263 | None | None | None | XRAY | 3.05 | 0.228 | 0.272 | B | 292.0 | 278.0 | 8 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vds | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNLB | Q00535 | 1 | 292 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.886 | 14.8508 | BLAminus | -135.82, 173.41 | 59.96, 81.07 | -98.2, 33.32 | 283.07, 69.38 | -75.63, -27.28 | in-in | in | 8.4516 | Saltbr-in | 3.158 | HRD-in | -77.91, -53.06 | 63.81, 22.82 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0044 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.88, 159.89 | APE9-dihe-na | 67.72, 132.78 | APE8-dihe-in | -56.55, 142.64 | APE8-rot-in | 295.52 | APE67-dihe-in | -68.05, -20.23 | -51.27, -43.49 | APE12-dist-in | 12.8777 | APE11-dist-in | 10.1756 | APE10-dist-in | 6.3904 | APE9-dist-in | 3.2178 | D144N | None | None | XRAY | 2.2 | 0.216 | 0.219 | B | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unl | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 3O0GA | Q00535 | 1 | 289 | 292.0 | No_ligand | No_ligand | Active | DFGin | 6.8294 | 15.2178 | BLAminus | -136.42, 175.77 | 61.32, 76.52 | -94.77, 26.39 | 279.12, 71.78 | -74.78, -15.11 | in-in | in | 8.7244 | Saltbr-in | 2.5526 | HRD-in | -79.72, -52.16 | 68.31, 13.14 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9154 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.07, 157.29 | APE9-dihe-na | 70.83, 127.92 | APE8-dihe-in | -52.36, 134.76 | APE8-rot-in | 293.6 | APE67-dihe-in | -63.53, -19.46 | -44.63, -48.78 | APE12-dist-in | 13.4692 | APE11-dist-in | 10.7286 | APE10-dist-in | 6.966 | APE9-dist-in | 3.2718 | D144N | None | None | XRAY | 1.95 | 0.228 | 0.256 | A | 292.0 | 289.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3o0g | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNGA | Q00535 | 1 | 292 | 292.0 | ALH:1293 | Type1 | Active | DFGin | 6.8038 | 15.5082 | BLAminus | -133.26, 177.58 | 62.73, 72.63 | -89.91, 24.29 | 283.27, 66.96 | -66.0, -18.39 | in-in | in | 8.9632 | Saltbr-in | 2.6515 | HRD-in | -78.57, -49.35 | 66.52, 4.37 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.7567 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.0, 143.2 | APE9-dihe-na | 84.58, 125.12 | APE8-dihe-in | -53.58, 144.18 | APE8-rot-in | 305.47 | APE67-dihe-in | -64.4, -16.61 | -47.26, -45.44 | APE12-dist-in | 13.7754 | APE11-dist-in | 10.8356 | APE10-dist-in | 7.0066 | APE9-dist-in | 3.4894 | D144N | None | None | XRAY | 2.3 | 0.216 | 0.225 | A | 292.0 | 288.0 | 4 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1ung | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNGB | Q00535 | 2 | 288 | 292.0 | ALH:1288 | Type1 | Active | DFGin | 6.7562 | 15.2398 | BLAminus | -135.97, 174.05 | 60.46, 78.03 | -103.9, 21.9 | 274.8, 75.17 | -65.02, -29.35 | in-in | in | 9.083 | Saltbr-in | 2.6574 | HRD-in | -79.66, -50.24 | 62.45, 11.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.0431 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -136.0, 151.25 | APE9-dihe-na | 73.87, 134.42 | APE8-dihe-in | -67.73, 142.85 | APE8-rot-in | 304.57 | APE67-dihe-in | -65.69, -18.42 | -33.73, -53.69 | APE12-dist-in | 12.9582 | APE11-dist-in | 9.5843 | APE10-dist-in | 6.5108 | APE9-dist-in | 3.3065 | D144N | None | None | XRAY | 2.3 | 0.216 | 0.225 | B | 292.0 | 269.0 | 18 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1ung | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNHA | Q00535 | 2 | 288 | 292.0 | IXM:1288 | Type1 | Active | DFGin | 6.7757 | 15.0921 | BLAminus | -140.41, 176.0 | 60.42, 76.79 | -95.69, 24.18 | 281.89, 69.34 | -62.09, -29.91 | in-in | in | 8.6743 | Saltbr-in | 2.9932 | HRD-in | -79.64, -52.48 | 66.83, 20.74 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8414 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.37, 151.6 | APE9-dihe-na | 72.7, 127.61 | APE8-dihe-in | -51.97, 137.86 | APE8-rot-in | 307.6 | APE67-dihe-in | -65.83, -14.98 | -38.09, -55.48 | APE12-dist-in | 13.0995 | APE11-dist-in | 9.8991 | APE10-dist-in | 6.9004 | APE9-dist-in | 3.3457 | D144N | None | None | XRAY | 2.35 | 0.229 | 0.23 | A | 292.0 | 277.0 | 10 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unh | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNHB | Q00535 | 2 | 288 | 292.0 | IXM:1288 | Type1 | Active | DFGin | 6.8388 | 15.1453 | BLAminus | -141.38, 178.67 | 60.42, 76.27 | -98.32, 21.68 | 277.9, 76.2 | -63.97, -22.06 | in-in | in | 8.6349 | Saltbr-in | 3.2558 | HRD-in | -75.22, -55.65 | 69.38, 16.95 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8267 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -140.18, 147.66 | APE9-dihe-na | 73.19, 127.24 | APE8-dihe-in | -46.64, 135.38 | APE8-rot-in | 297.76 | APE67-dihe-in | -66.71, -15.92 | -39.6, -54.16 | APE12-dist-in | 13.1463 | APE11-dist-in | 9.9739 | APE10-dist-in | 7.0516 | APE9-dist-in | 3.3187 | D144N | None | None | XRAY | 2.35 | 0.229 | 0.23 | B | 292.0 | 277.0 | 10 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unh | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 1UNLA | Q00535 | 1 | 292 | 292.0 | RRC:1293 | Type1 | Active | DFGin | 6.8293 | 15.2016 | BLAminus | -128.33, 173.21 | 66.87, 81.02 | -97.91, 23.56 | 283.17, 72.64 | -73.67, -20.59 | in-in | in | 8.3091 | Saltbr-in | 2.8471 | HRD-in | -82.56, -50.74 | 69.72, 10.97 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9193 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.08, 156.73 | APE9-dihe-na | 71.89, 126.73 | APE8-dihe-in | -48.26, 136.09 | APE8-rot-in | 296.72 | APE67-dihe-in | -59.67, -21.67 | -44.15, -47.77 | APE12-dist-in | 13.5586 | APE11-dist-in | 10.7803 | APE10-dist-in | 7.1047 | APE9-dist-in | 3.2635 | D144N | None | None | XRAY | 2.2 | 0.216 | 0.219 | A | 292.0 | 292.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 1unl | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 3O0GB | Q00535 | 6 | 288 | 292.0 | 3O0:293 | Type1 | Active | DFGin | 6.923 | 14.7947 | BLAminus | -129.48, 175.97 | 62.66, 84.26 | -100.98, 30.43 | 284.37, 72.05 | -63.02, -27.78 | in-in | in | 8.8214 | Saltbr-in | 2.7631 | HRD-in | -83.72, -54.01 | 67.99, 17.3 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8557 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -132.49, 157.23 | APE9-dihe-na | 72.19, 128.42 | APE8-dihe-in | -53.83, 140.52 | APE8-rot-in | 308.29 | APE67-dihe-in | -61.77, -21.68 | -45.86, -49.86 | APE12-dist-in | 12.7273 | APE11-dist-in | 9.9091 | APE10-dist-in | 6.3251 | APE9-dist-in | 3.248 | D144N | None | None | XRAY | 1.95 | 0.228 | 0.256 | B | 292.0 | 264.0 | 21 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 3o0g | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 8e-83 | 284.6 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDPA | Q00535 | 2 | 291 | 292.0 | 65L:301 | Type1 | Inactive | DFGin | 6.7648 | 15.3893 | BLAminus | -127.42, 170.52 | 67.24, 87.09 | -100.87, 23.21 | 283.17, 74.31 | -63.43, -25.09 | in-out | in | 8.8533 | Saltbr-out | 3.7283 | HRD-in | -78.41, -56.12 | 72.29, 8.93 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8658 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -134.29, 146.94 | APE9-dihe-na | 69.86, 130.59 | APE8-dihe-in | -56.21, 145.09 | APE8-rot-out | 66.15 | APE67-dihe-in | -65.94, -20.99 | -45.11, -46.74 | APE12-dist-in | 13.3218 | APE11-dist-in | 10.197 | APE10-dist-in | 6.9249 | APE9-dist-in | 3.3917 | None | None | None | XRAY | 2.09 | 0.202 | 0.229 | A | 292.0 | 287.0 | 3 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdp | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDPB | Q00535 | 3 | 288 | 292.0 | 65L:301 | Type1 | Inactive | DFGin | 6.7292 | 14.9863 | BLAminus | -127.65, 169.87 | 66.53, 89.09 | -101.2, 27.01 | 283.91, 72.42 | -67.19, -23.91 | in-out | in | 8.8191 | Saltbr-out | 3.7073 | HRD-in | -80.8, -59.5 | 69.85, 17.04 | out-in-out | SNCoio | in-out | ActLoopNT-in | 2.8868 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -137.89, 151.46 | APE9-dihe-na | 71.79, 133.86 | APE8-dihe-in | -61.46, 147.21 | APE8-rot-out | 65.8 | APE67-dihe-in | -67.63, -21.22 | -46.93, -48.84 | APE12-dist-in | 12.798 | APE11-dist-in | 9.6021 | APE10-dist-in | 6.4704 | APE9-dist-in | 3.3707 | None | None | None | XRAY | 2.09 | 0.202 | 0.229 | B | 292.0 | 279.0 | 7 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdp | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDQA | Q00535 | 2 | 291 | 292.0 | 64V:301 | Type1 | Inactive | DFGin | 6.6062 | 15.2883 | BLAminus | -126.33, 172.99 | 66.95, 84.9 | -102.8, 32.89 | 288.52, 70.91 | -63.45, -40.23 | in-in | in | 8.7668 | Saltbr-in | 2.9151 | HRD-in | -78.08, -59.02 | 67.94, 17.12 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8528 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -140.03, 142.95 | APE9-dihe-na | 72.97, 131.4 | APE8-dihe-in | -63.75, 141.79 | APE8-rot-out | 59.38 | APE67-dihe-in | -67.5, -17.15 | -39.1, -48.99 | APE12-dist-in | 13.3265 | APE11-dist-in | 10.4562 | APE10-dist-in | 6.9809 | APE9-dist-in | 3.343 | None | None | None | XRAY | 2.91 | 0.254 | 0.284 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdq | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDQB | Q00535 | 3 | 288 | 292.0 | 64V:301 | Type1 | Inactive | DFGin | 6.7029 | 15.3713 | BLAminus | -126.83, 173.21 | 67.53, 85.45 | -103.83, 35.8 | 289.7, 71.3 | -66.2, -38.73 | in-in | in | 8.902 | Saltbr-in | 2.9093 | HRD-in | -79.53, -57.9 | 70.89, 16.51 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8736 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -139.15, 143.9 | APE9-dihe-na | 74.88, 143.9 | APE8-dihe-in | -77.64, 140.07 | APE8-rot-out | 62.74 | APE67-dihe-in | -67.14, -19.69 | -37.77, -52.43 | APE12-dist-in | 12.7444 | APE11-dist-in | 9.9205 | APE10-dist-in | 6.6672 | APE9-dist-in | 3.3445 | None | None | None | XRAY | 2.91 | 0.254 | 0.284 | B | 292.0 | 277.0 | 9 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdq | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDRA | Q00535 | 2 | 291 | 292.0 | 63I:301 | Type1 | Inactive | DFGin | 6.6266 | 15.74 | BLAminus | -129.05, 171.62 | 69.47, 86.46 | -104.09, 25.41 | 283.64, 74.23 | -68.34, -21.06 | in-in | in | 8.8803 | Saltbr-in | 3.314 | HRD-in | -78.35, -59.52 | 73.04, 14.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8632 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -137.3, 138.66 | APE9-dihe-na | 71.75, 135.69 | APE8-dihe-in | -66.11, 146.84 | APE8-rot-out | 71.82 | APE67-dihe-in | -69.63, -20.89 | -44.06, -44.5 | APE12-dist-in | 13.0087 | APE11-dist-in | 9.9559 | APE10-dist-in | 6.9609 | APE9-dist-in | 3.3204 | None | None | None | XRAY | 2.55 | 0.221 | 0.256 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdr | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDRB | Q00535 | 3 | 288 | 292.0 | 63I:301 | Type1 | Inactive | DFGin | 6.5755 | 15.3317 | BLAminus | -129.35, 171.52 | 69.7, 87.29 | -105.48, 25.0 | 285.38, 76.15 | -68.91, -20.79 | in-in | in | 8.8894 | Saltbr-in | 3.2949 | HRD-in | -80.02, -61.31 | 72.56, 17.73 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8656 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -136.41, 145.43 | APE9-dihe-na | 74.65, 138.0 | APE8-dihe-in | -69.3, 148.16 | APE8-rot-out | 71.5 | APE67-dihe-in | -71.13, -20.44 | -45.23, -46.82 | APE12-dist-in | 12.9322 | APE11-dist-in | 9.9297 | APE10-dist-in | 6.82 | APE9-dist-in | 3.3178 | None | None | None | XRAY | 2.55 | 0.221 | 0.256 | B | 292.0 | 275.0 | 11 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vdr | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 7VDSA | Q00535 | 2 | 291 | 292.0 | 61U:301 | Type1 | Inactive | DFGin | 6.5205 | 15.3292 | BLAminus | -137.7, 177.02 | 65.97, 88.94 | -109.08, 27.6 | 287.56, 67.14 | -63.86, -33.05 | in-in | in | 8.6242 | Saltbr-in | 3.3531 | HRD-in | -79.29, -55.01 | 68.82, 18.0 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.8448 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iiii | APE10-dihe-na | -138.28, 148.16 | APE9-dihe-na | 77.03, 134.42 | APE8-dihe-in | -61.09, 132.18 | APE8-rot-out | 39.92 | APE67-dihe-in | -70.87, -20.07 | -38.56, -38.27 | APE12-dist-in | 13.1199 | APE11-dist-in | 10.3195 | APE10-dist-in | 6.5539 | APE9-dist-in | 3.394 | None | None | None | XRAY | 3.05 | 0.228 | 0.272 | A | 292.0 | 290.0 | 0 | 28 | 28 | 0 | [[4, 286]] | 1.0 | 7vds | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 4AU8A | Q00535 | 2 | 289 | 292.0 | Z3R:61293 | Type1 | Inactive | DFGin | 7.1122 | 15.1372 | BLAminus | -135.37, 172.87 | 64.95, 77.01 | -97.51, 18.8 | 282.03, 77.47 | -65.91, -19.1 | in-in | in | 8.2084 | Saltbr-in | 2.6454 | HRD-in | -73.52, -48.92 | 73.07, -7.77 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.9444 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iooi | APE10-dihe-na | -144.11, 169.24 | APE9-dihe-na | -57.47, 146.77 | APE8-dihe-in | -51.22, 149.12 | APE8-rot-out | 191.34 | APE67-dihe-in | -62.35, -21.28 | -39.22, -50.79 | APE12-dist-in | 12.0461 | APE11-dist-out | 6.6974 | APE10-dist-out | 8.6457 | APE9-dist-in | 3.8759 | None | None | None | XRAY | 1.9 | 0.197 | 0.234 | A | 296.0 | 274.0 | 14 | 28 | 26 | 2 | [[4, 286]] | 1.0 | 4au8 | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4.2e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| CDK5 | CDK5_HUMAN | 4AU8B | Q00535 | 2 | 289 | 292.0 | Z3R:61293 | Type1 | Inactive | DFGin | 7.2608 | 15.5319 | BLAminus | -136.24, 169.41 | 66.3, 80.09 | -99.68, 21.4 | 281.94, 79.2 | -66.25, -19.98 | in-in | in | 8.1283 | Saltbr-in | 2.8349 | HRD-in | -70.21, -48.16 | 75.6, -7.91 | in-in-out | SNCiio | in-out | ActLoopNT-in | 2.947 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoi | APE10-dihe-na | 999.0, 152.31 | APE9-dihe-na | -57.56, 146.64 | APE8-dihe-in | -53.33, 139.32 | APE8-rot-out | 196.17 | APE67-dihe-in | -60.73, -25.67 | -36.04, -48.68 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 8.8336 | APE9-dist-in | 3.8301 | None | None | None | XRAY | 1.9 | 0.197 | 0.234 | B | 296.0 | 277.0 | 11 | 28 | 22 | 6 | [[4, 286]] | 1.0 | 4au8 | Homo sapiens | CMGC_CDK5_HUMAN | CMGC | 4.2e-84 | 288.8 | 1.0 | 301.0 | 301.0 | 143 | 144 | 145 | 147 | 149 | 33 | 51 | 55 | 123 | 125 | 124 | 126.0 | 184 | 171 | 166 | 165 | 164 | 163 | 162 | 161 | 160 | 81 | Cyclin-dependent kinase 5 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| Gene | 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 |
|---|