Ligand: 0HD

Total number of chains: 4
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 3V8SA
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
AGC ROCK1 ROCK1_HUMAN 3V8SA Q13464 8 402 1354.0 0HD:501 Type1 Inactive DFGin 6.144 13.365 BLAminus -131.47, 179.47 60.6, 71.6 -93.5, 10.81 305.1, 96.77 -59.12, -15.76 in-in in 8.804 Saltbr-in 2.742 HRD-in -66.59, -53.55 76.27, -10.47 in-in-out SNCiio in-out ActLoopNT-in 2.987 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -127.49, 177.7 APE9-dihe-na 96.83, -154.47 APE8-dihe-in -129.74, 143.67 APE8-rot-out 110.69 APE67-dihe-in -64.74, -31.71 -49.91, -44.47 APE12-dist-in 10.402 APE11-dist-in 11.776 APE10-dist-in 5.941 APE9-dist-in 3.727 None None None XRAY 2.286 0.188 0.236 A 410 395 0 0 0 0 [[76, 338]] 1.0 3v8s AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SB Q13464 6 402 1354.0 0HD:501 Type1 Inactive DFGin 6.313 13.649 BLAminus -129.24, 179.74 58.53, 76.73 -94.51, 12.02 303.63, 98.77 -47.53, -31.19 in-in in 8.826 Saltbr-in 3.279 HRD-in -71.19, -49.28 79.11, -22.55 in-in-out SNCiio in-out ActLoopNT-in 2.975 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oiio APE10-dihe-na -114.6, -175.49 APE9-dihe-na -78.94, -129.14 APE8-dihe-in -42.78, 130.14 APE8-rot-in 309.49 APE67-dihe-in -49.83, -43.8 -72.71, -13.77 APE12-dist-out 6.676 APE11-dist-in 10.194 APE10-dist-in 7.063 APE9-dist-out 9.407 None None None XRAY 2.286 0.188 0.236 B 410 397 0 0 0 0 [[76, 338]] 1.0 3v8s AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SC Q13464 8 402 1354.0 0HD:501 Type1 Inactive DFGin 6.229 13.48 BLAminus -131.94, 178.46 61.35, 70.46 -92.71, 10.99 301.74, 97.6 -57.75, -20.03 in-in in 8.789 Saltbr-in 2.919 HRD-in -68.58, -53.3 74.86, -10.72 in-in-out SNCiio in-out ActLoopNT-in 2.931 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -128.32, 170.47 APE9-dihe-na 100.83, -158.56 APE8-dihe-in -121.14, 144.0 APE8-rot-out 104.69 APE67-dihe-in -65.81, -32.6 -49.38, -42.89 APE12-dist-in 10.322 APE11-dist-in 11.73 APE10-dist-in 5.877 APE9-dist-in 3.799 None None None XRAY 2.286 0.188 0.236 C 410 395 0 0 0 0 [[76, 338]] 1.0 3v8s AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SD Q13464 6 402 1354.0 0HD:501 Type1 Inactive DFGin 6.274 13.681 BLAminus -134.51, 177.57 58.27, 76.4 -93.55, 11.58 303.68, 94.09 -46.72, -30.67 in-in in 8.887 Saltbr-in 3.229 HRD-in -77.06, -45.91 77.83, -23.23 in-in-out SNCiio in-out ActLoopNT-in 2.86 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioo APE10-dihe-na -92.44, 115.48 APE9-dihe-na -69.73, -64.71 APE8-dihe-in -105.78, 124.29 APE8-rot-in 283.0 APE67-dihe-in -50.65, -45.32 -72.98, -15.17 APE12-dist-in 7.382 APE11-dist-in 10.194 APE10-dist-out 9.123 APE9-dist-out 9.352 None None None XRAY 2.286 0.188 0.236 D 410 397 0 0 0 0 [[76, 338]] 1.0 3v8s AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1

Ligand: 0HD

Total number of chains: 4
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 4 100.0% 3V8SA
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
AGC ROCK1 ROCK1_HUMAN 3V8SA Q13464 8 402 1354.0 0HD:501 Type1 Inactive DFGin 6.144 13.365 BLAminus -131.47, 179.47 60.6, 71.6 -93.5, 10.81 305.1, 96.77 -59.12, -15.76 in-in in 8.804 Saltbr-in 2.742 HRD-in -66.59, -53.55 76.27, -10.47 in-in-out SNCiio in-out ActLoopNT-in 2.987 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -127.49, 177.7 APE9-dihe-na 96.83, -154.47 APE8-dihe-in -129.74, 143.67 APE8-rot-out 110.69 APE67-dihe-in -64.74, -31.71 -49.91, -44.47 APE12-dist-in 10.402 APE11-dist-in 11.776 APE10-dist-in 5.941 APE9-dist-in 3.727 None None None XRAY 2.286 0.188 0.236 A 410 395 0 0 0 0 [[76, 338]] 1.0 3v8s Homo sapiens AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SB Q13464 6 402 1354.0 0HD:501 Type1 Inactive DFGin 6.313 13.649 BLAminus -129.24, 179.74 58.53, 76.73 -94.51, 12.02 303.63, 98.77 -47.53, -31.19 in-in in 8.826 Saltbr-in 3.279 HRD-in -71.19, -49.28 79.11, -22.55 in-in-out SNCiio in-out ActLoopNT-in 2.975 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_oiio APE10-dihe-na -114.6, -175.49 APE9-dihe-na -78.94, -129.14 APE8-dihe-in -42.78, 130.14 APE8-rot-in 309.49 APE67-dihe-in -49.83, -43.8 -72.71, -13.77 APE12-dist-out 6.676 APE11-dist-in 10.194 APE10-dist-in 7.063 APE9-dist-out 9.407 None None None XRAY 2.286 0.188 0.236 B 410 397 0 0 0 0 [[76, 338]] 1.0 3v8s Homo sapiens AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SC Q13464 8 402 1354.0 0HD:501 Type1 Inactive DFGin 6.229 13.48 BLAminus -131.94, 178.46 61.35, 70.46 -92.71, 10.99 301.74, 97.6 -57.75, -20.03 in-in in 8.789 Saltbr-in 2.919 HRD-in -68.58, -53.3 74.86, -10.72 in-in-out SNCiio in-out ActLoopNT-in 2.931 ActLoopCT-out nonTYR APEdihe_aaioi APEdist_iiii APE10-dihe-na -128.32, 170.47 APE9-dihe-na 100.83, -158.56 APE8-dihe-in -121.14, 144.0 APE8-rot-out 104.69 APE67-dihe-in -65.81, -32.6 -49.38, -42.89 APE12-dist-in 10.322 APE11-dist-in 11.73 APE10-dist-in 5.877 APE9-dist-in 3.799 None None None XRAY 2.286 0.188 0.236 C 410 395 0 0 0 0 [[76, 338]] 1.0 3v8s Homo sapiens AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1
AGC ROCK1 ROCK1_HUMAN 3V8SD Q13464 6 402 1354.0 0HD:501 Type1 Inactive DFGin 6.274 13.681 BLAminus -134.51, 177.57 58.27, 76.4 -93.55, 11.58 303.68, 94.09 -46.72, -30.67 in-in in 8.887 Saltbr-in 3.229 HRD-in -77.06, -45.91 77.83, -23.23 in-in-out SNCiio in-out ActLoopNT-in 2.86 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iioo APE10-dihe-na -92.44, 115.48 APE9-dihe-na -69.73, -64.71 APE8-dihe-in -105.78, 124.29 APE8-rot-in 283.0 APE67-dihe-in -50.65, -45.32 -72.98, -15.17 APE12-dist-in 7.382 APE11-dist-in 10.194 APE10-dist-out 9.123 APE9-dist-out 9.352 None None None XRAY 2.286 0.188 0.236 D 410 397 0 0 0 0 [[76, 338]] 1.0 3v8s Homo sapiens AGC_ROCK1_HUMAN AGC 3.4e-94 320.8 1 260 260 215 216 217 219 221 105 124 128 195 197 196 198 260 244 239 238 237 236 235 234 233 154 Rho-associated protein kinase 1

Ligand: 0HD

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