Ligand: XGS

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% 5S7RB
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
TKL ACVR1 ACVR1_HUMAN 5S7RB Q04771 205 499 509.0 LU8:501,XGS:505,XGS:506,XGS:507,XGS:508,XGS:509,XGS:510 Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric Inactive DFGin 6.9508 13.305 BLAminus -123.51, 161.17 75.08, 89.73 -101.63, 18.32 302.56, 179.54 -66.27, -18.2 in-out in 8.7282 Saltbr-out 4.7541 HRD-in -80.45, -51.89 79.75, -1.22 out-in-out SNCoio in-out ActLoopNT-in 2.924 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -118.67, 165.96 APE9-dihe-na -61.08, 162.39 APE8-dihe-in -58.43, 128.17 APE8-rot-in 299.47 APE67-dihe-in -59.07, -29.26 -60.13, -43.27 APE12-dist-in 10.3121 APE11-dist-out 6.1071 APE10-dist-out 9.0326 APE9-dist-in 3.8788 Q207D None None XRAY 1.46 0.173 0.198 B 301.0 292.0 3 32 32 0 [[207, 497]] 1.0 5s7r TKL_ACVR1_HUMAN TKL 1.9e-85 292.5 2.0 267.0 266.0 353 354 355 357 359 235 248 252 333 335 334 336.0 403 385 380 379 378 377 376 375 374 284 Activin receptor type-1
TKL ACVR1 ACVR1_HUMAN 5S7RA Q04771 202 499 509.0 LU8:501,LU8:507,LU8:508,XGS:509,XGS:510,XGS:511,XGS:512,XGS:513 Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric Inactive DFGin 8.3785 13.2666 BLAminus -118.49, 160.3 77.59, 89.22 -102.83, 29.26 299.84, 3.52 -70.9, -18.65 in-out in 9.1133 Saltbr-out 6.2461 HRD-in -79.07, -53.38 77.46, -1.57 out-in-out SNCoio in-out ActLoopNT-in 2.9231 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooi APE10-dihe-na -126.05, 166.06 APE9-dihe-na -58.33, 162.52 APE8-dihe-in -61.2, 125.14 APE8-rot-in 304.32 APE67-dihe-in -53.36, -31.96 -64.07, -40.51 APE12-dist-none 999.0 APE11-dist-out 6.0853 APE10-dist-out 8.9465 APE9-dist-in 3.7151 Q207D None None XRAY 1.46 0.173 0.198 A 301.0 283.0 15 32 19 13 [[207, 497]] 1.0 5s7r TKL_ACVR1_HUMAN TKL 1.9e-85 292.5 2.0 267.0 266.0 353 354 355 357 359 235 248 252 333 335 334 336.0 403 385 380 379 378 377 376 375 374 284 Activin receptor type-1

Ligand: XGS

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% 5S7RB
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
TKL ACVR1 ACVR1_HUMAN 5S7RB Q04771 205 499 509.0 LU8:501,XGS:505,XGS:506,XGS:507,XGS:508,XGS:509,XGS:510 Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric Inactive DFGin 6.9508 13.305 BLAminus -123.51, 161.17 75.08, 89.73 -101.63, 18.32 302.56, 179.54 -66.27, -18.2 in-out in 8.7282 Saltbr-out 4.7541 HRD-in -80.45, -51.89 79.75, -1.22 out-in-out SNCoio in-out ActLoopNT-in 2.924 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_iooi APE10-dihe-na -118.67, 165.96 APE9-dihe-na -61.08, 162.39 APE8-dihe-in -58.43, 128.17 APE8-rot-in 299.47 APE67-dihe-in -59.07, -29.26 -60.13, -43.27 APE12-dist-in 10.3121 APE11-dist-out 6.1071 APE10-dist-out 9.0326 APE9-dist-in 3.8788 Q207D None None XRAY 1.46 0.173 0.198 B 301.0 292.0 3 32 32 0 [[207, 497]] 1.0 5s7r Homo sapiens TKL_ACVR1_HUMAN TKL 1.9e-85 292.5 2.0 267.0 266.0 353 354 355 357 359 235 248 252 333 335 334 336.0 403 385 380 379 378 377 376 375 374 284 Activin receptor type-1
TKL ACVR1 ACVR1_HUMAN 5S7RA Q04771 202 499 509.0 LU8:501,LU8:507,LU8:508,XGS:509,XGS:510,XGS:511,XGS:512,XGS:513 Type1,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric,Allosteric Inactive DFGin 8.3785 13.2666 BLAminus -118.49, 160.3 77.59, 89.22 -102.83, 29.26 299.84, 3.52 -70.9, -18.65 in-out in 9.1133 Saltbr-out 6.2461 HRD-in -79.07, -53.38 77.46, -1.57 out-in-out SNCoio in-out ActLoopNT-in 2.9231 ActLoopCT-out nonTYR APEdihe_aaiii APEdist_nooi APE10-dihe-na -126.05, 166.06 APE9-dihe-na -58.33, 162.52 APE8-dihe-in -61.2, 125.14 APE8-rot-in 304.32 APE67-dihe-in -53.36, -31.96 -64.07, -40.51 APE12-dist-none 999.0 APE11-dist-out 6.0853 APE10-dist-out 8.9465 APE9-dist-in 3.7151 Q207D None None XRAY 1.46 0.173 0.198 A 301.0 283.0 15 32 19 13 [[207, 497]] 1.0 5s7r Homo sapiens TKL_ACVR1_HUMAN TKL 1.9e-85 292.5 2.0 267.0 266.0 353 354 355 357 359 235 248 252 333 335 334 336.0 403 385 380 379 378 377 376 375 374 284 Activin receptor type-1

Ligand: XGS

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