| Group | 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 | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | CAMKK2 | KKCC2_HUMAN | 6CMJA | Q96RR4 | 161 | 463 | 588.0 | F6J:60501 | Type1 | Active | DFGin | 6.7009 | 14.0205 | BLAminus | -128.16, 173.53 | 66.84, 86.55 | -100.45, 21.53 | 286.63, 76.45 | -58.11, -34.47 | in-in | in | 9.5163 | Saltbr-in | 2.7082 | HRD-in | -70.27, -50.6 | 73.87, 2.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9477 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.24, 163.41 | APE9-dihe-na | 103.64, -157.45 | APE8-dihe-in | -90.88, 126.33 | APE8-rot-in | 303.07 | APE67-dihe-in | -67.03, -16.03 | -51.77, -42.09 | APE12-dist-in | 9.9798 | APE11-dist-in | 11.1344 | APE10-dist-in | 5.2592 | APE9-dist-in | 3.8169 | None | SEP345,SEP400,TPO462 | SEP345,SEP400,TPO462 | XRAY | 2.4 | 0.184 | 0.219 | A | 321.0 | 288.0 | 0 | 28 | 28 | 0 | [[165, 446]] | 1.0 | 6cmj | CAMK_CAMKK2_HUMAN | CAMK | 2.4e-75 | 259.1 | 1.0 | 256.0 | 256.0 | 329 | 330 | 331 | 333 | 335 | 194 | 236 | 240 | 309 | 311 | 310 | 312.0 | 372 | 357 | 352 | 351 | 350 | 349 | 348 | 347 | 346 | 268 | Calcium/calmodulin-dependent protein kinase kinase 2 |
| CAMK | CAMKK2 | KKCC2_HUMAN | 6CMJB | Q96RR4 | 161 | 462 | 588.0 | F6J:60501 | Type1 | Active | DFGin | 6.5539 | 14.022 | BLAminus | -126.23, 173.65 | 67.8, 86.78 | -100.71, 20.95 | 284.77, 76.92 | -57.77, -33.94 | in-in | in | 9.4714 | Saltbr-in | 2.7026 | HRD-in | -69.56, -50.79 | 72.39, 3.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.937 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.14, 163.72 | APE9-dihe-na | 103.15, -157.71 | APE8-dihe-in | -91.26, 126.78 | APE8-rot-in | 302.39 | APE67-dihe-in | -66.21, -16.47 | -51.31, -43.01 | APE12-dist-in | 9.8488 | APE11-dist-in | 11.0819 | APE10-dist-in | 5.2245 | APE9-dist-in | 3.8201 | None | SEP345,SEP400,TPO462 | SEP345,SEP400,TPO462 | XRAY | 2.4 | 0.184 | 0.219 | B | 321.0 | 287.0 | 0 | 28 | 28 | 0 | [[165, 446]] | 1.0 | 6cmj | CAMK_CAMKK2_HUMAN | CAMK | 2.4e-75 | 259.1 | 1.0 | 256.0 | 256.0 | 329 | 330 | 331 | 333 | 335 | 194 | 236 | 240 | 309 | 311 | 310 | 312.0 | 372 | 357 | 352 | 351 | 350 | 349 | 348 | 347 | 346 | 268 | Calcium/calmodulin-dependent protein kinase kinase 2 |
| Group | 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CAMK | CAMKK2 | KKCC2_HUMAN | 6CMJA | Q96RR4 | 161 | 463 | 588.0 | F6J:60501 | Type1 | Active | DFGin | 6.7009 | 14.0205 | BLAminus | -128.16, 173.53 | 66.84, 86.55 | -100.45, 21.53 | 286.63, 76.45 | -58.11, -34.47 | in-in | in | 9.5163 | Saltbr-in | 2.7082 | HRD-in | -70.27, -50.6 | 73.87, 2.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9477 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.24, 163.41 | APE9-dihe-na | 103.64, -157.45 | APE8-dihe-in | -90.88, 126.33 | APE8-rot-in | 303.07 | APE67-dihe-in | -67.03, -16.03 | -51.77, -42.09 | APE12-dist-in | 9.9798 | APE11-dist-in | 11.1344 | APE10-dist-in | 5.2592 | APE9-dist-in | 3.8169 | None | SEP345,SEP400,TPO462 | SEP345,SEP400,TPO462 | XRAY | 2.4 | 0.184 | 0.219 | A | 321.0 | 288.0 | 0 | 28 | 28 | 0 | [[165, 446]] | 1.0 | 6cmj | Homo sapiens | CAMK_CAMKK2_HUMAN | CAMK | 2.4e-75 | 259.1 | 1.0 | 256.0 | 256.0 | 329 | 330 | 331 | 333 | 335 | 194 | 236 | 240 | 309 | 311 | 310 | 312.0 | 372 | 357 | 352 | 351 | 350 | 349 | 348 | 347 | 346 | 268 | Calcium/calmodulin-dependent protein kinase kinase 2 |
| CAMK | CAMKK2 | KKCC2_HUMAN | 6CMJB | Q96RR4 | 161 | 462 | 588.0 | F6J:60501 | Type1 | Active | DFGin | 6.5539 | 14.022 | BLAminus | -126.23, 173.65 | 67.8, 86.78 | -100.71, 20.95 | 284.77, 76.92 | -57.77, -33.94 | in-in | in | 9.4714 | Saltbr-in | 2.7026 | HRD-in | -69.56, -50.79 | 72.39, 3.04 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.937 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.14, 163.72 | APE9-dihe-na | 103.15, -157.71 | APE8-dihe-in | -91.26, 126.78 | APE8-rot-in | 302.39 | APE67-dihe-in | -66.21, -16.47 | -51.31, -43.01 | APE12-dist-in | 9.8488 | APE11-dist-in | 11.0819 | APE10-dist-in | 5.2245 | APE9-dist-in | 3.8201 | None | SEP345,SEP400,TPO462 | SEP345,SEP400,TPO462 | XRAY | 2.4 | 0.184 | 0.219 | B | 321.0 | 287.0 | 0 | 28 | 28 | 0 | [[165, 446]] | 1.0 | 6cmj | Homo sapiens | CAMK_CAMKK2_HUMAN | CAMK | 2.4e-75 | 259.1 | 1.0 | 256.0 | 256.0 | 329 | 330 | 331 | 333 | 335 | 194 | 236 | 240 | 309 | 311 | 310 | 312.0 | 372 | 357 | 352 | 351 | 350 | 349 | 348 | 347 | 346 | 268 | Calcium/calmodulin-dependent protein kinase kinase 2 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| Group | 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 |
|---|