| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | PRKG1 | KGP1_HUMAN | 6BG2A | Q13976 | 336 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.8108 | 14.7141 | BLAminus | -124.15, 169.14 | 66.07, 88.5 | -100.57, 30.98 | 280.35, 66.41 | -65.35, -25.12 | in-in | in | 9.5223 | Saltbr-in | 2.8826 | HRD-in | -85.83, -52.95 | 73.29, 9.38 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8514 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.93, 165.57 | APE9-dihe-na | 117.74, 172.78 | APE8-dihe-in | -83.6, 129.51 | APE8-rot-in | 307.46 | APE67-dihe-in | -66.9, -19.23 | -49.63, -41.3 | APE12-dist-in | 8.2348 | APE11-dist-in | 11.5121 | APE10-dist-in | 6.0409 | APE9-dist-in | 4.269 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | A | 347.0 | 336.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2B | Q13976 | 346 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 6.0006 | 13.8103 | BLAminus | -122.67, 175.58 | 65.94, 84.43 | -99.77, 30.78 | 285.96, 70.42 | -64.93, -24.07 | in-in | in | 8.944 | Saltbr-in | 2.7425 | HRD-in | -86.95, -52.47 | 73.99, 7.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9238 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.61, 163.67 | APE9-dihe-na | 118.96, 172.39 | APE8-dihe-in | -86.94, 131.94 | APE8-rot-in | 306.51 | APE67-dihe-in | -68.79, -20.88 | -48.58, -41.68 | APE12-dist-in | 7.8257 | APE11-dist-in | 11.2147 | APE10-dist-in | 5.7688 | APE9-dist-in | 4.0083 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | B | 347.0 | 326.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2C | Q13976 | 337 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.7459 | 14.0572 | BLAminus | -122.99, 175.03 | 65.66, 84.22 | -99.61, 30.7 | 281.62, 66.26 | -64.81, -23.57 | in-in | in | 8.7415 | Saltbr-in | 2.7233 | HRD-in | -85.99, -53.51 | 74.31, 7.4 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9506 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.66, 165.85 | APE9-dihe-na | 118.46, 173.18 | APE8-dihe-in | -87.41, 130.75 | APE8-rot-in | 306.63 | APE67-dihe-in | -67.71, -19.03 | -48.39, -42.55 | APE12-dist-in | 7.9723 | APE11-dist-in | 11.3847 | APE10-dist-in | 5.8567 | APE9-dist-in | 3.8612 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | C | 347.0 | 335.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2D | Q13976 | 344 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.7098 | 14.0124 | BLAminus | -124.49, 174.79 | 65.67, 84.87 | -99.37, 30.45 | 283.38, 66.11 | -64.13, -22.3 | in-in | in | 8.754 | Saltbr-in | 2.6441 | HRD-in | -85.68, -52.69 | 74.16, 8.99 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9303 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.92, 166.42 | APE9-dihe-na | 119.53, 169.97 | APE8-dihe-in | -84.81, 130.45 | APE8-rot-in | 305.19 | APE67-dihe-in | -66.29, -19.88 | -48.13, -43.31 | APE12-dist-in | 7.9878 | APE11-dist-in | 11.3267 | APE10-dist-in | 5.7839 | APE9-dist-in | 3.8102 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | D | 347.0 | 328.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AGC | PRKG1 | KGP1_HUMAN | 6BG2A | Q13976 | 336 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.8108 | 14.7141 | BLAminus | -124.15, 169.14 | 66.07, 88.5 | -100.57, 30.98 | 280.35, 66.41 | -65.35, -25.12 | in-in | in | 9.5223 | Saltbr-in | 2.8826 | HRD-in | -85.83, -52.95 | 73.29, 9.38 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8514 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -152.93, 165.57 | APE9-dihe-na | 117.74, 172.78 | APE8-dihe-in | -83.6, 129.51 | APE8-rot-in | 307.46 | APE67-dihe-in | -66.9, -19.23 | -49.63, -41.3 | APE12-dist-in | 8.2348 | APE11-dist-in | 11.5121 | APE10-dist-in | 6.0409 | APE9-dist-in | 4.269 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | A | 347.0 | 336.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | Homo sapiens | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2B | Q13976 | 346 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 6.0006 | 13.8103 | BLAminus | -122.67, 175.58 | 65.94, 84.43 | -99.77, 30.78 | 285.96, 70.42 | -64.93, -24.07 | in-in | in | 8.944 | Saltbr-in | 2.7425 | HRD-in | -86.95, -52.47 | 73.99, 7.96 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9238 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.61, 163.67 | APE9-dihe-na | 118.96, 172.39 | APE8-dihe-in | -86.94, 131.94 | APE8-rot-in | 306.51 | APE67-dihe-in | -68.79, -20.88 | -48.58, -41.68 | APE12-dist-in | 7.8257 | APE11-dist-in | 11.2147 | APE10-dist-in | 5.7688 | APE9-dist-in | 4.0083 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | B | 347.0 | 326.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | Homo sapiens | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2C | Q13976 | 337 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.7459 | 14.0572 | BLAminus | -122.99, 175.03 | 65.66, 84.22 | -99.61, 30.7 | 281.62, 66.26 | -64.81, -23.57 | in-in | in | 8.7415 | Saltbr-in | 2.7233 | HRD-in | -85.99, -53.51 | 74.31, 7.4 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9506 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.66, 165.85 | APE9-dihe-na | 118.46, 173.18 | APE8-dihe-in | -87.41, 130.75 | APE8-rot-in | 306.63 | APE67-dihe-in | -67.71, -19.03 | -48.39, -42.55 | APE12-dist-in | 7.9723 | APE11-dist-in | 11.3847 | APE10-dist-in | 5.8567 | APE9-dist-in | 3.8612 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | C | 347.0 | 335.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | Homo sapiens | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| AGC | PRKG1 | KGP1_HUMAN | 6BG2D | Q13976 | 344 | 671 | 671.0 | ANP:700 | ATPlike | Active | DFGin | 5.7098 | 14.0124 | BLAminus | -124.49, 174.79 | 65.67, 84.87 | -99.37, 30.45 | 283.38, 66.11 | -64.13, -22.3 | in-in | in | 8.754 | Saltbr-in | 2.6441 | HRD-in | -85.68, -52.69 | 74.16, 8.99 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.9303 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -151.92, 166.42 | APE9-dihe-na | 119.53, 169.97 | APE8-dihe-in | -84.81, 130.45 | APE8-rot-in | 305.19 | APE67-dihe-in | -66.29, -19.88 | -48.13, -43.31 | APE12-dist-in | 7.9878 | APE11-dist-in | 11.3267 | APE10-dist-in | 5.7839 | APE9-dist-in | 3.8102 | None | TPO517 | TPO517 | XRAY | 1.83 | 0.188 | 0.215 | D | 347.0 | 328.0 | 0 | 27 | 27 | 0 | [[360, 619]] | 1.0 | 6bg2 | Homo sapiens | AGC_PRKG1_HUMAN | AGC | 2.6e-84 | 288.3 | 1.0 | 260.0 | 260.0 | 501 | 502 | 503 | 505 | 507 | 390 | 409 | 413 | 481 | 483 | 482 | 484.0 | 540 | 528 | 523 | 522 | 521 | 520 | 519 | 518 | 517 | 439 | cGMP-dependent protein kinase 1 |
| 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 |
|---|