Ligand: CC9

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 9FPXB
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 DYRK1A DYR1A_HUMAN 9FPXA Q13627 136 479 763.0 CC9:501 Type1 Active DFGin 7.6395 14.5644 BLAminus -128.52, -179.85 64.32, 75.88 -96.77, 27.03 289.01, 77.19 -67.47, -43.12 in-in in 8.672 Saltbr-in 2.7674 HRD-in -68.22, -36.96 69.23, -0.41 in-in-in SNCiii in-in ActLoopNT-in 2.8043 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -90.19, -47.98 APE9-dihe-na -95.05, 163.26 APE8-dihe-in -63.48, 147.02 APE8-rot-in 273.59 APE67-dihe-in -53.12, -33.33 -58.72, -55.68 APE12-dist-in 12.0514 APE11-dist-in 10.9747 APE10-dist-in 7.1282 APE9-dist-in 3.3041 None PTR321 PTR321 XRAY 2.69 0.242 0.278 A 371.0 337.0 7 25 25 0 [[159, 479]] 1.0 9fpx CMGC_DYRK1A_HUMAN CMGC 9.3e-91 310.1 1.0 301.0 301.0 306 307 308 310 312 188 203 207 284 286 285 287.0 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC DYRK1A DYR1A_HUMAN 9FPXB Q13627 143 480 763.0 CC9:501 Type1 Active DFGin 7.4914 14.3556 BLAminus -125.11, 175.25 58.16, 79.65 -98.94, 25.54 294.99, 76.36 -62.08, -51.42 in-in in 8.96 Saltbr-in 3.0422 HRD-in -68.96, -37.47 65.08, 10.01 in-in-in SNCiii in-in ActLoopNT-in 2.4304 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -109.35, 179.3 APE9-dihe-na 69.75, 147.35 APE8-dihe-in -76.68, 135.47 APE8-rot-in 286.81 APE67-dihe-in -53.4, -25.2 -48.11, -54.23 APE12-dist-in 12.1328 APE11-dist-in 11.3195 APE10-dist-in 7.011 APE9-dist-in 3.2151 None PTR321 PTR321 XRAY 2.69 0.242 0.278 B 371.0 337.0 1 25 25 0 [[159, 479]] 1.0 9fpx CMGC_DYRK1A_HUMAN CMGC 9.3e-91 310.1 1.0 301.0 301.0 306 307 308 310 312 188 203 207 284 286 285 287.0 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC DYRK2 DYRK2_HUMAN 6HDRA Q92630 146 536 601.0 CC9:60501 Type1 Inactive DFGin 6.9387 14.8325 BLAminus -116.98, -175.8 60.97, 77.21 -96.77, 23.88 280.67, 81.52 -78.88, -6.9 in-in in 9.3283 Saltbr-in 3.5045 HRD-in -71.46, -52.99 79.25, 3.29 in-in-out SNCiio in-out ActLoopNT-in 2.8036 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -130.88, 167.44 APE9-dihe-na 70.73, 153.88 APE8-dihe-in -70.98, 134.66 APE8-rot-out 177.54 APE67-dihe-in -61.24, -20.91 -50.8, -48.3 APE12-dist-in 12.8854 APE11-dist-in 11.3565 APE10-dist-in 6.8992 APE9-dist-in 3.2221 None PTR382,SEP458 PTR382,SEP458 XRAY 2.2 0.192 0.243 A 429.0 389.0 2 25 25 0 [[222, 535]] 1.0 6hdr CMGC_DYRK2_HUMAN CMGC 1.5e-98 335.8 1.0 301.0 301.0 367 368 369 371 373 251 266 270 345 347 346 348.0 404 392 387 386 385 384 383 382 381 302 Dual specificity tyrosine-phosphorylation-regulated kinase 2

Ligand: CC9

Total number of chains: 3
Active chains: 2
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 3 100.0% 9FPXB
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 DYRK1A DYR1A_HUMAN 9FPXA Q13627 136 479 763.0 CC9:501 Type1 Active DFGin 7.6395 14.5644 BLAminus -128.52, -179.85 64.32, 75.88 -96.77, 27.03 289.01, 77.19 -67.47, -43.12 in-in in 8.672 Saltbr-in 2.7674 HRD-in -68.22, -36.96 69.23, -0.41 in-in-in SNCiii in-in ActLoopNT-in 2.8043 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -90.19, -47.98 APE9-dihe-na -95.05, 163.26 APE8-dihe-in -63.48, 147.02 APE8-rot-in 273.59 APE67-dihe-in -53.12, -33.33 -58.72, -55.68 APE12-dist-in 12.0514 APE11-dist-in 10.9747 APE10-dist-in 7.1282 APE9-dist-in 3.3041 None PTR321 PTR321 XRAY 2.69 0.242 0.278 A 371.0 337.0 7 25 25 0 [[159, 479]] 1.0 9fpx Homo sapiens CMGC_DYRK1A_HUMAN CMGC 9.3e-91 310.1 1.0 301.0 301.0 306 307 308 310 312 188 203 207 284 286 285 287.0 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC DYRK1A DYR1A_HUMAN 9FPXB Q13627 143 480 763.0 CC9:501 Type1 Active DFGin 7.4914 14.3556 BLAminus -125.11, 175.25 58.16, 79.65 -98.94, 25.54 294.99, 76.36 -62.08, -51.42 in-in in 8.96 Saltbr-in 3.0422 HRD-in -68.96, -37.47 65.08, 10.01 in-in-in SNCiii in-in ActLoopNT-in 2.4304 ActLoopCT-in nonTYR APEdihe_aaiii APEdist_iiii APE10-dihe-na -109.35, 179.3 APE9-dihe-na 69.75, 147.35 APE8-dihe-in -76.68, 135.47 APE8-rot-in 286.81 APE67-dihe-in -53.4, -25.2 -48.11, -54.23 APE12-dist-in 12.1328 APE11-dist-in 11.3195 APE10-dist-in 7.011 APE9-dist-in 3.2151 None PTR321 PTR321 XRAY 2.69 0.242 0.278 B 371.0 337.0 1 25 25 0 [[159, 479]] 1.0 9fpx Homo sapiens CMGC_DYRK1A_HUMAN CMGC 9.3e-91 310.1 1.0 301.0 301.0 306 307 308 310 312 188 203 207 284 286 285 287.0 343 331 326 325 324 323 322 321 320 239 Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CMGC DYRK2 DYRK2_HUMAN 6HDRA Q92630 146 536 601.0 CC9:60501 Type1 Inactive DFGin 6.9387 14.8325 BLAminus -116.98, -175.8 60.97, 77.21 -96.77, 23.88 280.67, 81.52 -78.88, -6.9 in-in in 9.3283 Saltbr-in 3.5045 HRD-in -71.46, -52.99 79.25, 3.29 in-in-out SNCiio in-out ActLoopNT-in 2.8036 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -130.88, 167.44 APE9-dihe-na 70.73, 153.88 APE8-dihe-in -70.98, 134.66 APE8-rot-out 177.54 APE67-dihe-in -61.24, -20.91 -50.8, -48.3 APE12-dist-in 12.8854 APE11-dist-in 11.3565 APE10-dist-in 6.8992 APE9-dist-in 3.2221 None PTR382,SEP458 PTR382,SEP458 XRAY 2.2 0.192 0.243 A 429.0 389.0 2 25 25 0 [[222, 535]] 1.0 6hdr Homo sapiens CMGC_DYRK2_HUMAN CMGC 1.5e-98 335.8 1.0 301.0 301.0 367 368 369 371 373 251 266 270 345 347 346 348.0 404 392 387 386 385 384 383 382 381 302 Dual specificity tyrosine-phosphorylation-regulated kinase 2

Ligand: CC9

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