| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| OTHER | ULK1 | ULK1_HUMAN | 8P5IA | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8543 | 15.0101 | BLAminus | -132.47, 178.38 | 59.3, 78.68 | -99.79, 21.2 | 280.63, 74.94 | -65.92, -24.22 | in-in | in | 7.7426 | Saltbr-in | 2.7384 | HRD-in | -87.08, -52.42 | 75.91, 5.56 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9243 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -154.56, 162.92 | APE9-dihe-na | 114.56, -177.62 | APE8-dihe-in | -103.24, 119.54 | APE8-rot-in | 304.75 | APE67-dihe-in | -70.24, -17.05 | -47.06, -38.5 | APE12-dist-in | 8.3111 | APE11-dist-in | 11.3199 | APE10-dist-in | 5.7798 | APE9-dist-in | 3.3055 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | A | 284.0 | 269.0 | 4 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5IB | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8984 | 14.8398 | BLAminus | -129.1, 177.11 | 61.64, 78.93 | -100.83, 21.26 | 281.6, 74.19 | -65.98, -26.25 | in-in | in | 7.6673 | Saltbr-in | 2.7207 | HRD-in | -85.48, -53.24 | 77.19, 3.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9109 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.71, 164.36 | APE9-dihe-na | 118.27, -176.57 | APE8-dihe-in | -102.53, 119.09 | APE8-rot-in | 302.14 | APE67-dihe-in | -71.25, -16.28 | -48.97, -37.63 | APE12-dist-in | 8.2551 | APE11-dist-in | 11.3059 | APE10-dist-in | 5.7591 | APE9-dist-in | 3.2918 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | B | 284.0 | 273.0 | 0 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5IC | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8704 | 14.8798 | BLAminus | -130.11, 176.72 | 61.62, 78.88 | -101.16, 21.61 | 281.23, 74.41 | -64.54, -26.89 | in-in | in | 7.7181 | Saltbr-in | 2.6977 | HRD-in | -87.1, -53.42 | 78.29, 2.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8856 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.06, 163.91 | APE9-dihe-na | 118.09, -176.74 | APE8-dihe-in | -100.74, 119.49 | APE8-rot-in | 302.38 | APE67-dihe-in | -71.93, -15.23 | -47.78, -38.17 | APE12-dist-in | 8.3026 | APE11-dist-in | 11.3237 | APE10-dist-in | 5.7697 | APE9-dist-in | 3.2881 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | C | 284.0 | 273.0 | 0 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5ID | O75385 | 8 | 279 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.9134 | 15.0493 | BLAminus | -134.0, 178.42 | 60.12, 80.07 | -100.07, 20.83 | 281.33, 74.97 | -65.11, -28.02 | in-in | in | 7.826 | Saltbr-in | 2.7435 | HRD-in | -85.08, -53.74 | 77.56, 2.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9227 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.45, 165.99 | APE9-dihe-na | 114.39, -178.66 | APE8-dihe-in | -101.96, 120.18 | APE8-rot-in | 308.2 | APE67-dihe-in | -70.62, -15.62 | -46.32, -39.81 | APE12-dist-in | 8.2976 | APE11-dist-in | 11.3172 | APE10-dist-in | 5.775 | APE9-dist-in | 3.3144 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | D | 284.0 | 267.0 | 5 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| OTHER | ULK1 | ULK1_HUMAN | 8P5IA | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8543 | 15.0101 | BLAminus | -132.47, 178.38 | 59.3, 78.68 | -99.79, 21.2 | 280.63, 74.94 | -65.92, -24.22 | in-in | in | 7.7426 | Saltbr-in | 2.7384 | HRD-in | -87.08, -52.42 | 75.91, 5.56 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9243 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -154.56, 162.92 | APE9-dihe-na | 114.56, -177.62 | APE8-dihe-in | -103.24, 119.54 | APE8-rot-in | 304.75 | APE67-dihe-in | -70.24, -17.05 | -47.06, -38.5 | APE12-dist-in | 8.3111 | APE11-dist-in | 11.3199 | APE10-dist-in | 5.7798 | APE9-dist-in | 3.3055 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | A | 284.0 | 269.0 | 4 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | Homo sapiens | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5IB | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8984 | 14.8398 | BLAminus | -129.1, 177.11 | 61.64, 78.93 | -100.83, 21.26 | 281.6, 74.19 | -65.98, -26.25 | in-in | in | 7.6673 | Saltbr-in | 2.7207 | HRD-in | -85.48, -53.24 | 77.19, 3.22 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9109 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -153.71, 164.36 | APE9-dihe-na | 118.27, -176.57 | APE8-dihe-in | -102.53, 119.09 | APE8-rot-in | 302.14 | APE67-dihe-in | -71.25, -16.28 | -48.97, -37.63 | APE12-dist-in | 8.2551 | APE11-dist-in | 11.3059 | APE10-dist-in | 5.7591 | APE9-dist-in | 3.2918 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | B | 284.0 | 273.0 | 0 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | Homo sapiens | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5IC | O75385 | 8 | 280 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.8704 | 14.8798 | BLAminus | -130.11, 176.72 | 61.62, 78.88 | -101.16, 21.61 | 281.23, 74.41 | -64.54, -26.89 | in-in | in | 7.7181 | Saltbr-in | 2.6977 | HRD-in | -87.1, -53.42 | 78.29, 2.85 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8856 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -155.06, 163.91 | APE9-dihe-na | 118.09, -176.74 | APE8-dihe-in | -100.74, 119.49 | APE8-rot-in | 302.38 | APE67-dihe-in | -71.93, -15.23 | -47.78, -38.17 | APE12-dist-in | 8.3026 | APE11-dist-in | 11.3237 | APE10-dist-in | 5.7697 | APE9-dist-in | 3.2881 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | C | 284.0 | 273.0 | 0 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | Homo sapiens | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| OTHER | ULK1 | ULK1_HUMAN | 8P5ID | O75385 | 8 | 279 | 1050.0 | WYX:301 | Type1 | Active | DFGin | 6.9134 | 15.0493 | BLAminus | -134.0, 178.42 | 60.12, 80.07 | -100.07, 20.83 | 281.33, 74.97 | -65.11, -28.02 | in-in | in | 7.826 | Saltbr-in | 2.7435 | HRD-in | -85.08, -53.74 | 77.56, 2.53 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9227 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.45, 165.99 | APE9-dihe-na | 114.39, -178.66 | APE8-dihe-in | -101.96, 120.18 | APE8-rot-in | 308.2 | APE67-dihe-in | -70.62, -15.62 | -46.32, -39.81 | APE12-dist-in | 8.2976 | APE11-dist-in | 11.3172 | APE10-dist-in | 5.775 | APE9-dist-in | 3.3144 | R245A,E246A | TPO180 | TPO180 | XRAY | 1.829 | 0.167 | 0.189 | D | 284.0 | 267.0 | 5 | 27 | 27 | 0 | [[14, 278]] | 1.0 | 8p5i | Homo sapiens | OTHER_ULK1_HUMAN | ULK | 1.7e-132 | 446.4 | 1.0 | 256.0 | 256.0 | 164 | 165 | 166 | 168 | 170 | 46 | 63 | 67 | 135 | 137 | 136 | 138.0 | 203 | 191 | 186 | 185 | 184 | 183 | 182 | 181 | 180 | 93 | Serine/threonine-protein kinase ULK1 |
| 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 |
|---|