Ligand: CJM

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 6B3EA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
CMGC CDK12 CDK12_HUMAN 6B3EA Q9NYV4 717 1036 1490.0 CJM:1102 Type1 Inactive DFGin 7.202 14.7664 BLAminus -121.7, 178.92 59.35, 79.81 -95.65, 26.66 285.79, 81.49 -61.82, -29.55 in-in in 8.6992 Saltbr-in 3.05 HRD-in -76.48, -54.37 70.53, 12.96 in-in-out SNCiio in-out ActLoopNT-in 2.9145 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -129.0, 155.78 APE9-dihe-na 76.06, 131.42 APE8-dihe-in -60.49, 145.1 APE8-rot-out 86.32 APE67-dihe-in -63.58, -25.36 -47.54, -46.44 APE12-dist-in 13.3552 APE11-dist-in 11.458 APE10-dist-in 6.9768 APE9-dist-in 3.4966 None TPO893 TPO893 XRAY 3.06 0.191 0.212 A 320.0 310.0 10 29 29 0 [[727, 1020]] 1.0 6b3e CMGC_CDK12_HUMAN CMGC 2e-84 289.3 1.0 301.0 301.0 876 877 878 880 882 756 774 778 856 858 857 859.0 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6B3EC Q9NYV4 719 1036 1490.0 CJM:1103 Type1 Inactive DFGin 7.173 14.6207 BLAminus -121.27, -179.9 57.69, 80.64 -96.21, 26.0 285.96, 80.56 -59.62, -30.89 in-in in 8.5283 Saltbr-in 2.8376 HRD-in -74.96, -53.91 69.51, 14.07 in-in-out SNCiio in-out ActLoopNT-in 2.8936 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -129.93, 154.64 APE9-dihe-na 78.03, 130.48 APE8-dihe-in -61.1, 145.82 APE8-rot-out 85.07 APE67-dihe-in -62.57, -25.75 -47.61, -47.19 APE12-dist-in 13.2674 APE11-dist-in 11.359 APE10-dist-in 6.9435 APE9-dist-in 3.5617 None TPO893 TPO893 XRAY 3.06 0.191 0.212 C 320.0 308.0 10 29 29 0 [[727, 1020]] 1.0 6b3e CMGC_CDK12_HUMAN CMGC 2e-84 289.3 1.0 301.0 301.0 876 877 878 880 882 756 774 778 856 858 857 859.0 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12

Ligand: CJM

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 6B3EA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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
CMGC CDK12 CDK12_HUMAN 6B3EA Q9NYV4 717 1036 1490.0 CJM:1102 Type1 Inactive DFGin 7.202 14.7664 BLAminus -121.7, 178.92 59.35, 79.81 -95.65, 26.66 285.79, 81.49 -61.82, -29.55 in-in in 8.6992 Saltbr-in 3.05 HRD-in -76.48, -54.37 70.53, 12.96 in-in-out SNCiio in-out ActLoopNT-in 2.9145 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -129.0, 155.78 APE9-dihe-na 76.06, 131.42 APE8-dihe-in -60.49, 145.1 APE8-rot-out 86.32 APE67-dihe-in -63.58, -25.36 -47.54, -46.44 APE12-dist-in 13.3552 APE11-dist-in 11.458 APE10-dist-in 6.9768 APE9-dist-in 3.4966 None TPO893 TPO893 XRAY 3.06 0.191 0.212 A 320.0 310.0 10 29 29 0 [[727, 1020]] 1.0 6b3e Homo sapiens CMGC_CDK12_HUMAN CMGC 2e-84 289.3 1.0 301.0 301.0 876 877 878 880 882 756 774 778 856 858 857 859.0 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6B3EC Q9NYV4 719 1036 1490.0 CJM:1103 Type1 Inactive DFGin 7.173 14.6207 BLAminus -121.27, -179.9 57.69, 80.64 -96.21, 26.0 285.96, 80.56 -59.62, -30.89 in-in in 8.5283 Saltbr-in 2.8376 HRD-in -74.96, -53.91 69.51, 14.07 in-in-out SNCiio in-out ActLoopNT-in 2.8936 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -129.93, 154.64 APE9-dihe-na 78.03, 130.48 APE8-dihe-in -61.1, 145.82 APE8-rot-out 85.07 APE67-dihe-in -62.57, -25.75 -47.61, -47.19 APE12-dist-in 13.2674 APE11-dist-in 11.359 APE10-dist-in 6.9435 APE9-dist-in 3.5617 None TPO893 TPO893 XRAY 3.06 0.191 0.212 C 320.0 308.0 10 29 29 0 [[727, 1020]] 1.0 6b3e Homo sapiens CMGC_CDK12_HUMAN CMGC 2e-84 289.3 1.0 301.0 301.0 876 877 878 880 882 756 774 778 856 858 857 859.0 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12

Ligand: CJM

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Hover over column headers for tooltip help.

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