| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9A | Q5S007 | 1329 | 2527 | 2527.0 | ATP:2602 | ATPlike | Active | DFGin | 6.2733 | 13.4102 | BLAminus | -138.23, -175.7 | 59.6, 64.71 | -84.85, 53.99 | 305.84, 101.34 | -78.49, -28.55 | in-in | in | 7.8797 | Saltbr-in | 2.7348 | HRD-in | -107.83, -47.31 | 66.25, 1.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.031 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.21, 156.34 | APE9-dihe-na | 139.24, 152.96 | APE8-dihe-in | -67.96, 127.7 | APE8-rot-in | 305.42 | APE67-dihe-inflip | 98.56, -16.69 | -58.5, 136.92 | APE12-dist-in | 9.1834 | APE11-dist-in | 11.4868 | APE10-dist-in | 6.0039 | APE9-dist-in | 3.8159 | None | None | None | EM | 3.48 | 999.0 | 999.0 | A | 2527.0 | 1173.0 | 0 | 26 | 26 | 0 | [[1875, 2134]] | 1.0 | 8fo9 | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9C | Q5S007 | 1329 | 2527 | 2527.0 | ATP:2602 | ATPlike | Active | DFGin | 6.2753 | 13.4053 | BLAminus | -138.14, -175.77 | 59.5, 64.85 | -84.95, 53.97 | 305.9, 101.31 | -78.52, -28.52 | in-in | in | 7.8828 | Saltbr-in | 2.7293 | HRD-in | -108.59, -47.2 | 66.33, 1.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.008 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.94, 156.21 | APE9-dihe-na | 139.37, 152.96 | APE8-dihe-in | -67.92, 127.71 | APE8-rot-in | 305.58 | APE67-dihe-inflip | 98.46, -16.81 | -58.61, 136.94 | APE12-dist-in | 9.1767 | APE11-dist-in | 11.5032 | APE10-dist-in | 6.012 | APE9-dist-in | 3.8041 | None | None | None | EM | 3.48 | 999.0 | 999.0 | C | 2527.0 | 1173.0 | 0 | 26 | 26 | 0 | [[1875, 2134]] | 1.0 | 8fo9 | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9F | Q5S007 | 12 | 2527 | 2527.0 | ATP:2602 | ATPlike | Inactive | DFGinter | 9.3478 | 8.5752 | None | -68.36, 152.72 | -137.53, 18.95 | -81.54, -22.77 | 187.88, 51.61 | -70.19, -36.74 | out-out | out | 11.2379 | Saltbr-out | 8.3264 | HRD-in | -76.93, -42.26 | 72.06, -11.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.1058 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -70.82, -18.07 | APE9-dihe-na | 87.94, 175.98 | APE8-dihe-in | -63.48, 135.16 | APE8-rot-in | 300.23 | APE67-dihe-in | -66.37, -45.6 | -58.88, -37.04 | APE12-dist-in | 9.7177 | APE11-dist-in | 10.5775 | APE10-dist-out | 14.122 | APE9-dist-in | 4.4728 | None | None | None | EM | 3.48 | 999.0 | 999.0 | F | 2527.0 | 2289.0 | 3 | 26 | 23 | 3 | [[1875, 2134]] | 1.0 | 8fo9 | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9E | Q5S007 | 12 | 2527 | 2527.0 | ATP:2602 | ATPlike | Inactive | DFGout | 11.3745 | 7.913 | None | -68.54, 152.71 | -137.53, 21.65 | -90.85, -9.64 | 146.2, 91.59 | -82.02, -36.47 | out-out | out | 11.1602 | Saltbr-out | 8.209 | HRD-in | -76.97, -42.35 | 72.15, -11.11 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.123 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -70.77, -18.05 | APE9-dihe-na | 87.91, 175.95 | APE8-dihe-in | -63.49, 135.16 | APE8-rot-in | 300.24 | APE67-dihe-in | -66.44, -45.65 | -58.78, -37.14 | APE12-dist-in | 9.6513 | APE11-dist-in | 10.5523 | APE10-dist-out | 14.083 | APE9-dist-in | 4.472 | None | None | None | EM | 3.48 | 999.0 | 999.0 | E | 2527.0 | 2287.0 | 3 | 26 | 23 | 3 | [[1875, 2134]] | 1.0 | 8fo9 | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9A | Q5S007 | 1329 | 2527 | 2527.0 | ATP:2602 | ATPlike | Active | DFGin | 6.2733 | 13.4102 | BLAminus | -138.23, -175.7 | 59.6, 64.71 | -84.85, 53.99 | 305.84, 101.34 | -78.49, -28.55 | in-in | in | 7.8797 | Saltbr-in | 2.7348 | HRD-in | -107.83, -47.31 | 66.25, 1.81 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.031 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -138.21, 156.34 | APE9-dihe-na | 139.24, 152.96 | APE8-dihe-in | -67.96, 127.7 | APE8-rot-in | 305.42 | APE67-dihe-inflip | 98.56, -16.69 | -58.5, 136.92 | APE12-dist-in | 9.1834 | APE11-dist-in | 11.4868 | APE10-dist-in | 6.0039 | APE9-dist-in | 3.8159 | None | None | None | EM | 3.48 | 999.0 | 999.0 | A | 2527.0 | 1173.0 | 0 | 26 | 26 | 0 | [[1875, 2134]] | 1.0 | 8fo9 | Homo sapiens | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9C | Q5S007 | 1329 | 2527 | 2527.0 | ATP:2602 | ATPlike | Active | DFGin | 6.2753 | 13.4053 | BLAminus | -138.14, -175.77 | 59.5, 64.85 | -84.95, 53.97 | 305.9, 101.31 | -78.52, -28.52 | in-in | in | 7.8828 | Saltbr-in | 2.7293 | HRD-in | -108.59, -47.2 | 66.33, 1.76 | in-in-in | SNCiii | in-in | ActLoopNT-in | 3.008 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -137.94, 156.21 | APE9-dihe-na | 139.37, 152.96 | APE8-dihe-in | -67.92, 127.71 | APE8-rot-in | 305.58 | APE67-dihe-inflip | 98.46, -16.81 | -58.61, 136.94 | APE12-dist-in | 9.1767 | APE11-dist-in | 11.5032 | APE10-dist-in | 6.012 | APE9-dist-in | 3.8041 | None | None | None | EM | 3.48 | 999.0 | 999.0 | C | 2527.0 | 1173.0 | 0 | 26 | 26 | 0 | [[1875, 2134]] | 1.0 | 8fo9 | Homo sapiens | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9F | Q5S007 | 12 | 2527 | 2527.0 | ATP:2602 | ATPlike | Inactive | DFGinter | 9.3478 | 8.5752 | None | -68.36, 152.72 | -137.53, 18.95 | -81.54, -22.77 | 187.88, 51.61 | -70.19, -36.74 | out-out | out | 11.2379 | Saltbr-out | 8.3264 | HRD-in | -76.93, -42.26 | 72.06, -11.17 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.1058 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -70.82, -18.07 | APE9-dihe-na | 87.94, 175.98 | APE8-dihe-in | -63.48, 135.16 | APE8-rot-in | 300.23 | APE67-dihe-in | -66.37, -45.6 | -58.88, -37.04 | APE12-dist-in | 9.7177 | APE11-dist-in | 10.5775 | APE10-dist-out | 14.122 | APE9-dist-in | 4.4728 | None | None | None | EM | 3.48 | 999.0 | 999.0 | F | 2527.0 | 2289.0 | 3 | 26 | 23 | 3 | [[1875, 2134]] | 1.0 | 8fo9 | Homo sapiens | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein kinase 2 |
| TKL | LRRK2 | LRRK2_HUMAN | 8FO9E | Q5S007 | 12 | 2527 | 2527.0 | ATP:2602 | ATPlike | Inactive | DFGout | 11.3745 | 7.913 | None | -68.54, 152.71 | -137.53, 21.65 | -90.85, -9.64 | 146.2, 91.59 | -82.02, -36.47 | out-out | out | 11.1602 | Saltbr-out | 8.209 | HRD-in | -76.97, -42.35 | 72.15, -11.11 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.123 | ActLoopCT-out | nonTYR | APEdihe_aaiii | APEdist_iioi | APE10-dihe-na | -70.77, -18.05 | APE9-dihe-na | 87.91, 175.95 | APE8-dihe-in | -63.49, 135.16 | APE8-rot-in | 300.24 | APE67-dihe-in | -66.44, -45.65 | -58.78, -37.14 | APE12-dist-in | 9.6513 | APE11-dist-in | 10.5523 | APE10-dist-out | 14.083 | APE9-dist-in | 4.472 | None | None | None | EM | 3.48 | 999.0 | 999.0 | E | 2527.0 | 2287.0 | 3 | 26 | 23 | 3 | [[1875, 2134]] | 1.0 | 8fo9 | Homo sapiens | TKL_LRRK2_HUMAN | TKL | 3.8e-57 | 200.3 | 5.0 | 266.0 | 262.0 | 2016 | 2017 | 2018 | 2020 | 2022 | 1906 | 1920 | 1924 | 1991 | 1993 | 1992 | 1994.0 | 2055 | 2042 | 2037 | 2036 | 2035 | 2034 | 2033 | 2032 | 2031 | 1948 | Leucine-rich repeat serine/threonine-protein 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 |
|---|