| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VB | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type1,ATPlike | Inactive | DFGin | 6.1927 | 14.1253 | BLBplus | -151.85, 167.5 | 59.4, 48.24 | -102.03, 163.4 | 46.52, 86.88 | -79.89, 84.21 | out-out | out | 15.5955 | Saltbr-out | 16.8415 | HRD-in | -72.2, -48.2 | 74.46, -6.51 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.7061 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -135.59, 156.7 | APE9-dihe-na | -122.67, 146.4 | APE8-dihe-out | -101.77, -26.6 | APE8-rot-in | 280.72 | APE67-dihe-out | -147.98, 135.29 | -136.69, 175.09 | APE12-dist-out | 16.923 | APE11-dist-out | 17.129 | APE10-dist-out | 21.8624 | APE9-dist-out | 12.4292 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | B | 395.0 | 322.0 | 29 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VH | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type1,ATPlike | Inactive | DFGin | 6.3491 | 14.2266 | BLBplus | -152.81, 169.25 | 61.22, 47.15 | -103.13, 164.19 | 45.91, 94.17 | -79.63, 83.31 | out-out | out | 15.6315 | Saltbr-out | 15.9163 | HRD-in | -74.73, -48.72 | 73.54, -6.07 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.5069 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_oooo | APE10-dihe-na | -142.21, 151.98 | APE9-dihe-na | -130.61, 176.34 | APE8-dihe-out | -105.52, -25.24 | APE8-rot-out | 37.89 | APE67-dihe-out | -147.93, 136.16 | -136.73, 176.12 | APE12-dist-out | 17.2775 | APE11-dist-out | 17.5835 | APE10-dist-out | 22.1521 | APE9-dist-out | 13.0006 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | H | 395.0 | 318.0 | 33 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VD | Q02750 | 31 | 380 | 393.0 | CHU:401,ANP:402 | Type3,ATPlike | Inactive | DFGin | 6.3733 | 14.325 | BLBplus | -154.54, 169.16 | 62.18, 48.49 | -103.44, 163.24 | 44.6, 81.5 | -80.27, 83.26 | out-out | out | 16.0835 | Saltbr-out | 14.6053 | HRD-in | -72.92, -47.49 | 72.01, -5.54 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.4975 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -145.24, 151.58 | APE9-dihe-na | -129.14, 150.7 | APE8-dihe-out | -101.27, -25.48 | APE8-rot-in | 295.39 | APE67-dihe-out | -149.5, 133.8 | -134.87, 174.51 | APE12-dist-out | 17.6813 | APE11-dist-out | 17.5865 | APE10-dist-out | 22.6132 | APE9-dist-out | 12.7344 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | D | 395.0 | 315.0 | 35 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VF | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type3,ATPlike | Inactive | DFGin | 6.3482 | 14.2973 | BLBplus | -150.02, 162.92 | 66.4, 48.22 | -102.89, 163.79 | 46.62, 89.05 | -79.32, 84.9 | out-out | out | 15.5104 | Saltbr-out | 15.8816 | HRD-in | -75.24, -46.98 | 72.8, -6.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.801 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -127.4, 126.99 | APE9-dihe-na | -155.92, 117.08 | APE8-dihe-out | -98.23, -9.95 | APE8-rot-in | 320.72 | APE67-dihe-out | -148.49, 134.6 | -133.67, 172.28 | APE12-dist-out | 18.6736 | APE11-dist-out | 16.7401 | APE10-dist-out | 21.3436 | APE9-dist-out | 12.7026 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | F | 395.0 | 322.0 | 29 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| TKL | RAF1 | RAF1_HUMAN | 9O0VG | P04049 | 341 | 614 | 648.0 | 324:701 | Type1 | Inactive | DFGin | 6.6518 | 14.5256 | BLAminus | -136.91, -164.75 | 63.88, 58.79 | -91.51, 23.22 | 298.64, 111.76 | -69.75, -22.63 | in-in | in | 8.5288 | Saltbr-in | 2.8267 | HRD-in | -68.13, -46.19 | 73.7, -5.88 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3624 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -144.93, -171.41 | APE9-dihe-na | 95.72, -110.34 | APE8-dihe-in | -121.89, 159.4 | APE8-rot-out | 179.42 | APE67-dihe-in | -62.17, -27.08 | -108.22, -7.65 | APE12-dist-in | 9.3788 | APE11-dist-in | 8.988 | APE10-dist-out | 10.4038 | APE9-dist-out | 9.6609 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | G | 280.0 | 265.0 | 9 | 30 | 21 | 9 | [[349, 608]] | 1.0 | 9o0v | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VE | P04049 | 339 | 613 | 648.0 | 324:701 | Type1.5_Back | Inactive | DFGin | 5.8024 | 13.3404 | BLAplus | -138.88, -169.03 | 61.87, 34.79 | -104.64, 32.35 | 56.09, 93.36 | -64.43, -47.67 | out-none | out | 11.5845 | Saltbr-none | 999.0 | HRD-in | -66.6, -47.0 | 72.05, -8.97 | none-none-out | SNCnno | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | 56.8, 24.32 | APE9-dihe-na | -101.33, -80.31 | APE8-dihe-in | -132.61, 160.7 | APE8-rot-out | 180.75 | APE67-dihe-in | -62.26, -27.57 | -106.96, -6.66 | APE12-dist-in | 11.2624 | APE11-dist-in | 9.0411 | APE10-dist-out | 12.024 | APE9-dist-out | 9.4519 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | E | 280.0 | 261.0 | 14 | 30 | 16 | 14 | [[349, 608]] | 1.0 | 9o0v | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VC | P04049 | 339 | 614 | 648.0 | 324:701 | Type1 | Inactive | DFGin | 6.507 | 14.8484 | BLBminus | -135.62, -163.14 | 65.12, 48.02 | -88.94, 153.23 | 304.77, 118.58 | 148.73, -35.99 | in-in | in | 8.1644 | Saltbr-in | 3.3442 | HRD-in | -65.49, -42.82 | 73.84, -8.92 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3433 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoo | APE10-dihe-na | 999.0, -150.01 | APE9-dihe-na | 93.34, -107.4 | APE8-dihe-in | -126.38, 163.35 | APE8-rot-out | 180.01 | APE67-dihe-in | -65.89, -28.16 | -108.44, -15.01 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 9.4019 | APE9-dist-out | 7.9115 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | C | 280.0 | 264.0 | 12 | 30 | 18 | 12 | [[349, 608]] | 1.0 | 9o0v | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VA | P04049 | 339 | 612 | 648.0 | 324:701 | Type1.5_Back | Inactive | DFGin | 5.6121 | 13.5412 | BLBplus | -137.53, -168.14 | 60.68, 23.81 | -97.37, 165.11 | 62.5, 93.91 | 74.63, 173.9 | out-none | out | 11.5178 | Saltbr-none | 999.0 | HRD-in | -67.23, -47.12 | 72.36, -10.39 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 8.5821 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioo | APE10-dihe-na | -121.31, 23.23 | APE9-dihe-na | -94.2, -61.86 | APE8-dihe-in | -150.39, 162.26 | APE8-rot-out | 181.1 | APE67-dihe-in | -63.35, -28.52 | -106.79, -7.22 | APE12-dist-out | 14.0563 | APE11-dist-in | 11.3326 | APE10-dist-out | 13.0181 | APE9-dist-out | 9.5213 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | A | 280.0 | 266.0 | 8 | 30 | 22 | 8 | [[349, 608]] | 1.0 | 9o0v | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VB | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type1,ATPlike | Inactive | DFGin | 6.1927 | 14.1253 | BLBplus | -151.85, 167.5 | 59.4, 48.24 | -102.03, 163.4 | 46.52, 86.88 | -79.89, 84.21 | out-out | out | 15.5955 | Saltbr-out | 16.8415 | HRD-in | -72.2, -48.2 | 74.46, -6.51 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.7061 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -135.59, 156.7 | APE9-dihe-na | -122.67, 146.4 | APE8-dihe-out | -101.77, -26.6 | APE8-rot-in | 280.72 | APE67-dihe-out | -147.98, 135.29 | -136.69, 175.09 | APE12-dist-out | 16.923 | APE11-dist-out | 17.129 | APE10-dist-out | 21.8624 | APE9-dist-out | 12.4292 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | B | 395.0 | 322.0 | 29 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | Homo sapiens | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VH | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type1,ATPlike | Inactive | DFGin | 6.3491 | 14.2266 | BLBplus | -152.81, 169.25 | 61.22, 47.15 | -103.13, 164.19 | 45.91, 94.17 | -79.63, 83.31 | out-out | out | 15.6315 | Saltbr-out | 15.9163 | HRD-in | -74.73, -48.72 | 73.54, -6.07 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.5069 | ActLoopCT-out | nonTYR | APEdihe_aaooo | APEdist_oooo | APE10-dihe-na | -142.21, 151.98 | APE9-dihe-na | -130.61, 176.34 | APE8-dihe-out | -105.52, -25.24 | APE8-rot-out | 37.89 | APE67-dihe-out | -147.93, 136.16 | -136.73, 176.12 | APE12-dist-out | 17.2775 | APE11-dist-out | 17.5835 | APE10-dist-out | 22.1521 | APE9-dist-out | 13.0006 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | H | 395.0 | 318.0 | 33 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | Homo sapiens | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VD | Q02750 | 31 | 380 | 393.0 | CHU:401,ANP:402 | Type3,ATPlike | Inactive | DFGin | 6.3733 | 14.325 | BLBplus | -154.54, 169.16 | 62.18, 48.49 | -103.44, 163.24 | 44.6, 81.5 | -80.27, 83.26 | out-out | out | 16.0835 | Saltbr-out | 14.6053 | HRD-in | -72.92, -47.49 | 72.01, -5.54 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.4975 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -145.24, 151.58 | APE9-dihe-na | -129.14, 150.7 | APE8-dihe-out | -101.27, -25.48 | APE8-rot-in | 295.39 | APE67-dihe-out | -149.5, 133.8 | -134.87, 174.51 | APE12-dist-out | 17.6813 | APE11-dist-out | 17.5865 | APE10-dist-out | 22.6132 | APE9-dist-out | 12.7344 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | D | 395.0 | 315.0 | 35 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | Homo sapiens | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| STE | MAP2K1 | MP2K1_HUMAN | 9O0VF | Q02750 | 30 | 380 | 393.0 | CHU:401,ANP:402 | Type3,ATPlike | Inactive | DFGin | 6.3482 | 14.2973 | BLBplus | -150.02, 162.92 | 66.4, 48.22 | -102.89, 163.79 | 46.62, 89.05 | -79.32, 84.9 | out-out | out | 15.5104 | Saltbr-out | 15.8816 | HRD-in | -75.24, -46.98 | 72.8, -6.4 | out-out-out | SNCooo | out-out | ActLoopNT-out | 9.801 | ActLoopCT-out | nonTYR | APEdihe_aaoio | APEdist_oooo | APE10-dihe-na | -127.4, 126.99 | APE9-dihe-na | -155.92, 117.08 | APE8-dihe-out | -98.23, -9.95 | APE8-rot-in | 320.72 | APE67-dihe-out | -148.49, 134.6 | -133.67, 172.28 | APE12-dist-out | 18.6736 | APE11-dist-out | 16.7401 | APE10-dist-out | 21.3436 | APE9-dist-out | 12.7026 | S218A,S222A | None | None | XRAY | 3.5 | 0.208 | 0.254 | F | 395.0 | 322.0 | 29 | 26 | 26 | 0 | [[68, 361]] | 1.0 | 9o0v | Homo sapiens | STE_MAP2K1_HUMAN | STE | 1.1e-96 | 329.2 | 1.0 | 257.0 | 257.0 | 207 | 208 | 209 | 211 | 213 | 97 | 114 | 118 | 187 | 189 | 188 | 190.0 | 245 | 233 | 228 | 227 | 226 | 225 | 224 | 223 | 222 | 144 | Dual specificity mitogen-activated protein kinase kinase 1 |
| TKL | RAF1 | RAF1_HUMAN | 9O0VG | P04049 | 341 | 614 | 648.0 | 324:701 | Type1 | Inactive | DFGin | 6.6518 | 14.5256 | BLAminus | -136.91, -164.75 | 63.88, 58.79 | -91.51, 23.22 | 298.64, 111.76 | -69.75, -22.63 | in-in | in | 8.5288 | Saltbr-in | 2.8267 | HRD-in | -68.13, -46.19 | 73.7, -5.88 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3624 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | -144.93, -171.41 | APE9-dihe-na | 95.72, -110.34 | APE8-dihe-in | -121.89, 159.4 | APE8-rot-out | 179.42 | APE67-dihe-in | -62.17, -27.08 | -108.22, -7.65 | APE12-dist-in | 9.3788 | APE11-dist-in | 8.988 | APE10-dist-out | 10.4038 | APE9-dist-out | 9.6609 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | G | 280.0 | 265.0 | 9 | 30 | 21 | 9 | [[349, 608]] | 1.0 | 9o0v | Homo sapiens | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VE | P04049 | 339 | 613 | 648.0 | 324:701 | Type1.5_Back | Inactive | DFGin | 5.8024 | 13.3404 | BLAplus | -138.88, -169.03 | 61.87, 34.79 | -104.64, 32.35 | 56.09, 93.36 | -64.43, -47.67 | out-none | out | 11.5845 | Saltbr-none | 999.0 | HRD-in | -66.6, -47.0 | 72.05, -8.97 | none-none-out | SNCnno | none-out | ActLoopNT-none | 999.0 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_iioo | APE10-dihe-na | 56.8, 24.32 | APE9-dihe-na | -101.33, -80.31 | APE8-dihe-in | -132.61, 160.7 | APE8-rot-out | 180.75 | APE67-dihe-in | -62.26, -27.57 | -106.96, -6.66 | APE12-dist-in | 11.2624 | APE11-dist-in | 9.0411 | APE10-dist-out | 12.024 | APE9-dist-out | 9.4519 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | E | 280.0 | 261.0 | 14 | 30 | 16 | 14 | [[349, 608]] | 1.0 | 9o0v | Homo sapiens | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VC | P04049 | 339 | 614 | 648.0 | 324:701 | Type1 | Inactive | DFGin | 6.507 | 14.8484 | BLBminus | -135.62, -163.14 | 65.12, 48.02 | -88.94, 153.23 | 304.77, 118.58 | 148.73, -35.99 | in-in | in | 8.1644 | Saltbr-in | 3.3442 | HRD-in | -65.49, -42.82 | 73.84, -8.92 | in-in-out | SNCiio | in-out | ActLoopNT-in | 3.3433 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_nnoo | APE10-dihe-na | 999.0, -150.01 | APE9-dihe-na | 93.34, -107.4 | APE8-dihe-in | -126.38, 163.35 | APE8-rot-out | 180.01 | APE67-dihe-in | -65.89, -28.16 | -108.44, -15.01 | APE12-dist-none | 999.0 | APE11-dist-none | 999.0 | APE10-dist-out | 9.4019 | APE9-dist-out | 7.9115 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | C | 280.0 | 264.0 | 12 | 30 | 18 | 12 | [[349, 608]] | 1.0 | 9o0v | Homo sapiens | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| TKL | RAF1 | RAF1_HUMAN | 9O0VA | P04049 | 339 | 612 | 648.0 | 324:701 | Type1.5_Back | Inactive | DFGin | 5.6121 | 13.5412 | BLBplus | -137.53, -168.14 | 60.68, 23.81 | -97.37, 165.11 | 62.5, 93.91 | 74.63, 173.9 | out-none | out | 11.5178 | Saltbr-none | 999.0 | HRD-in | -67.23, -47.12 | 72.36, -10.39 | none-out-out | SNCnoo | out-out | ActLoopNT-out | 8.5821 | ActLoopCT-out | nonTYR | APEdihe_aaioi | APEdist_oioo | APE10-dihe-na | -121.31, 23.23 | APE9-dihe-na | -94.2, -61.86 | APE8-dihe-in | -150.39, 162.26 | APE8-rot-out | 181.1 | APE67-dihe-in | -63.35, -28.52 | -106.79, -7.22 | APE12-dist-out | 14.0563 | APE11-dist-in | 11.3326 | APE10-dist-out | 13.0181 | APE9-dist-out | 9.5213 | Y340D,Y341D | None | None | XRAY | 3.5 | 0.208 | 0.254 | A | 280.0 | 266.0 | 8 | 30 | 22 | 8 | [[349, 608]] | 1.0 | 9o0v | Homo sapiens | TKL_RAF1_HUMAN | TKL | 2.6e-81 | 279.0 | 3.0 | 266.0 | 264.0 | 485 | 486 | 487 | 489 | 491 | 375 | 393 | 397 | 465 | 467 | 466 | 468.0 | 530 | 515 | 510 | 509 | 508 | 507 | 506 | 505 | 504 | 422 | RAF proto-oncogene serine/threonine-protein kinase |
| 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 |
|---|