Ligand: RC8

Total number of chains: 5
Active chains: 3
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 100.0% 3DDPA
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 6TD3B Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Inactive DFGin 7.072 15.376 BLAminus -144.85, 177.87 66.18, 66.81 -86.27, 29.11 284.0, 81.86 -68.57, -26.95 in-in in 7.94 Saltbr-in 3.098 HRD-in -75.0, -46.5 66.33, 3.67 in-in-out SNCiio in-out ActLoopNT-in 2.962 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -130.74, 152.33 APE9-dihe-na 70.44, 153.31 APE8-dihe-in -72.7, 152.08 APE8-rot-out 190.09 APE67-dihe-in -62.32, -35.85 -49.81, -38.44 APE12-dist-in 13.58 APE11-dist-in 10.993 APE10-dist-in 7.153 APE9-dist-in 3.643 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 B 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6TD3E Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Active DFGin 7.044 15.193 BLAminus -147.32, 173.39 63.76, 65.42 -84.24, 25.56 288.49, 76.82 -64.44, -36.48 in-in in 7.974 Saltbr-in 3.167 HRD-in -75.19, -47.55 67.28, 2.07 in-in-in SNCiii in-in ActLoopNT-in 2.953 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -75.91, -39.12 APE9-dihe-na -86.17, 150.74 APE8-dihe-in -63.73, 141.42 APE8-rot-in 305.37 APE67-dihe-in -59.47, -32.88 -40.08, -54.92 APE12-dist-in 13.176 APE11-dist-in 11.902 APE10-dist-in 6.855 APE9-dist-in 3.435 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 E 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6TD3H Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Inactive DFGin 7.008 15.067 BLAminus -125.85, 165.87 77.73, 76.18 -92.06, 29.13 290.22, 73.9 -71.24, -38.15 in-in in 7.898 Saltbr-in 3.073 HRD-in -75.01, -45.87 63.18, 11.24 in-in-out SNCiio in-out ActLoopNT-in 2.959 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iiii APE10-dihe-na -152.2, 169.13 APE9-dihe-na 75.43, 19.72 APE8-dihe-out 60.33, 162.48 APE8-rot-out 98.13 APE67-dihe-in -64.24, -27.06 -78.21, -44.67 APE12-dist-in 13.905 APE11-dist-in 11.902 APE10-dist-in 7.407 APE9-dist-in 3.189 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 H 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK2 CDK2_HUMAN 3DDPA P24941 1 297 298.0 RC8:60299 Type1 Active DFGin 6.75 15.031 BLAminus -127.95, 179.43 46.52, 81.35 -92.16, 22.27 276.35, 73.24 -63.03, -31.46 in-in in 8.333 Saltbr-in 3.081 HRD-in -82.36, -50.36 62.52, 18.48 in-in-in SNCiii in-in ActLoopNT-in 3.023 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -158.09, 139.36 APE9-dihe-na 73.42, 128.44 APE8-dihe-in -50.13, 134.43 APE8-rot-in 283.7 APE67-dihe-in -56.68, -9.63 -42.52, -61.86 APE12-dist-in 13.006 APE11-dist-in 10.45 APE10-dist-in 7.666 APE9-dist-in 3.419 None TPO160 TPO160 XRAY 2.7 0.21 0.27 A 299 297 0 0 0 0 [[4, 286]] 1.0 3ddp CMGC_CDK2_HUMAN CMGC 6.4e-90 307.8 1 301 301 144 145 146 148 150 33 51 55 124 126 125 127 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2
CMGC CDK2 CDK2_HUMAN 3DDPC P24941 1 298 298.0 RC8:60299 Type1 Active DFGin 6.62 14.862 BLAminus -118.86, 173.91 46.65, 94.24 -104.11, 18.75 283.31, 63.56 -50.59, -37.26 in-in in 8.255 Saltbr-in 3.128 HRD-in -82.76, -47.36 68.04, 19.59 in-in-in SNCiii in-in ActLoopNT-in 2.96 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.71, 146.82 APE9-dihe-na 70.87, 140.11 APE8-dihe-in -54.32, 132.3 APE8-rot-in 319.96 APE67-dihe-in -62.39, -29.57 -44.26, -44.66 APE12-dist-in 13.205 APE11-dist-in 10.393 APE10-dist-in 7.453 APE9-dist-in 3.231 None TPO160 TPO160 XRAY 2.7 0.21 0.27 C 299 298 0 0 0 0 [[4, 286]] 1.0 3ddp CMGC_CDK2_HUMAN CMGC 6.4e-90 307.8 1 301 301 144 145 146 148 150 33 51 55 124 126 125 127 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2

Ligand: RC8

Total number of chains: 5
Active chains: 3
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 100.0% 3DDPA
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 6TD3B Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Inactive DFGin 7.072 15.376 BLAminus -144.85, 177.87 66.18, 66.81 -86.27, 29.11 284.0, 81.86 -68.57, -26.95 in-in in 7.94 Saltbr-in 3.098 HRD-in -75.0, -46.5 66.33, 3.67 in-in-out SNCiio in-out ActLoopNT-in 2.962 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -130.74, 152.33 APE9-dihe-na 70.44, 153.31 APE8-dihe-in -72.7, 152.08 APE8-rot-out 190.09 APE67-dihe-in -62.32, -35.85 -49.81, -38.44 APE12-dist-in 13.58 APE11-dist-in 10.993 APE10-dist-in 7.153 APE9-dist-in 3.643 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 B 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 Homo sapiens CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6TD3E Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Active DFGin 7.044 15.193 BLAminus -147.32, 173.39 63.76, 65.42 -84.24, 25.56 288.49, 76.82 -64.44, -36.48 in-in in 7.974 Saltbr-in 3.167 HRD-in -75.19, -47.55 67.28, 2.07 in-in-in SNCiii in-in ActLoopNT-in 2.953 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -75.91, -39.12 APE9-dihe-na -86.17, 150.74 APE8-dihe-in -63.73, 141.42 APE8-rot-in 305.37 APE67-dihe-in -59.47, -32.88 -40.08, -54.92 APE12-dist-in 13.176 APE11-dist-in 11.902 APE10-dist-in 6.855 APE9-dist-in 3.435 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 E 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 Homo sapiens CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 6TD3H Q9NYV4 715 1047 1490.0 RC8:1101 Type1 Inactive DFGin 7.008 15.067 BLAminus -125.85, 165.87 77.73, 76.18 -92.06, 29.13 290.22, 73.9 -71.24, -38.15 in-in in 7.898 Saltbr-in 3.073 HRD-in -75.01, -45.87 63.18, 11.24 in-in-out SNCiio in-out ActLoopNT-in 2.959 ActLoopCT-out nonTYR APEdihe_aaooi APEdist_iiii APE10-dihe-na -152.2, 169.13 APE9-dihe-na 75.43, 19.72 APE8-dihe-out 60.33, 162.48 APE8-rot-out 98.13 APE67-dihe-in -64.24, -27.06 -78.21, -44.67 APE12-dist-in 13.905 APE11-dist-in 11.902 APE10-dist-in 7.407 APE9-dist-in 3.189 K965R TPO893 TPO893 XRAY 3.46 0.195 0.22 H 344 333 0 0 0 0 [[727, 1020]] 1.0 6td3 Homo sapiens CMGC_CDK12_HUMAN CMGC 5.4e-84 287.9 1 301 301 876 877 878 880 882 756 774 778 856 858 857 859 918 905 900 899 898 897 896 895 894 814 Cyclin-dependent kinase 12
CMGC CDK2 CDK2_HUMAN 3DDPA P24941 1 297 298.0 RC8:60299 Type1 Active DFGin 6.75 15.031 BLAminus -127.95, 179.43 46.52, 81.35 -92.16, 22.27 276.35, 73.24 -63.03, -31.46 in-in in 8.333 Saltbr-in 3.081 HRD-in -82.36, -50.36 62.52, 18.48 in-in-in SNCiii in-in ActLoopNT-in 3.023 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -158.09, 139.36 APE9-dihe-na 73.42, 128.44 APE8-dihe-in -50.13, 134.43 APE8-rot-in 283.7 APE67-dihe-in -56.68, -9.63 -42.52, -61.86 APE12-dist-in 13.006 APE11-dist-in 10.45 APE10-dist-in 7.666 APE9-dist-in 3.419 None TPO160 TPO160 XRAY 2.7 0.21 0.27 A 299 297 0 0 0 0 [[4, 286]] 1.0 3ddp Homo sapiens CMGC_CDK2_HUMAN CMGC 6.4e-90 307.8 1 301 301 144 145 146 148 150 33 51 55 124 126 125 127 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2
CMGC CDK2 CDK2_HUMAN 3DDPC P24941 1 298 298.0 RC8:60299 Type1 Active DFGin 6.62 14.862 BLAminus -118.86, 173.91 46.65, 94.24 -104.11, 18.75 283.31, 63.56 -50.59, -37.26 in-in in 8.255 Saltbr-in 3.128 HRD-in -82.76, -47.36 68.04, 19.59 in-in-in SNCiii in-in ActLoopNT-in 2.96 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -146.71, 146.82 APE9-dihe-na 70.87, 140.11 APE8-dihe-in -54.32, 132.3 APE8-rot-in 319.96 APE67-dihe-in -62.39, -29.57 -44.26, -44.66 APE12-dist-in 13.205 APE11-dist-in 10.393 APE10-dist-in 7.453 APE9-dist-in 3.231 None TPO160 TPO160 XRAY 2.7 0.21 0.27 C 299 298 0 0 0 0 [[4, 286]] 1.0 3ddp Homo sapiens CMGC_CDK2_HUMAN CMGC 6.4e-90 307.8 1 301 301 144 145 146 148 150 33 51 55 124 126 125 127 185 172 167 166 165 164 163 162 161 81 Cyclin-dependent kinase 2

Ligand: RC8

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
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