Ligand: F3W

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 6GL9A
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
TYR JAK3-2 JAK3_HUMAN 6GL9A P52333 812 1103 1124.0 F3W:1201 Type1 Active DFGin 6.2475 14.0115 BLAminus -125.6, -168.17 49.24, 81.71 -98.97, 21.2 279.85, 75.03 -60.06, -26.17 in-in in 7.7934 Saltbr-in 2.6834 HRD-in -78.49, -49.26 75.45, 0.4 in-in-in SNCiii in-in ActLoopNT-in 2.7882 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -77.67, 117.53 APE9-dihe-in -98.8, 151.13 APE8-dihe-in -79.69, 90.74 APE8-rot-na 31.23 APE67-dihe-in -78.37, -0.16 -59.8, -32.45 APE12-dist-na 9.3301 APE11-dist-na 10.7633 APE10-dist-na 11.753 APE9-dist-in 6.9787 None None None XRAY 1.7 0.209 0.244 A 294.0 292.0 0 31 31 0 [[521, 779], [822, 1097]] 2.0 6gl9 TYR_JAK3-2_HUMAN TYR 4e-80 274.8 1.0 260.0 260.0 966 967 968 970 972 855 871 875 946 948 947 949.0 1009 997 992 991 990 989 988 987 986 903 Tyrosine-protein kinase JAK3
TYR JAK3-2 JAK3_HUMAN 6GL9B P52333 813 1103 1124.0 F3W:1201 Type1 Active DFGin 6.21 14.019 BLAminus -123.31, -164.34 42.61, 83.03 -97.02, 22.96 280.36, 70.4 -63.87, -26.0 in-in in 7.7595 Saltbr-in 2.667 HRD-in -78.77, -47.46 73.56, 0.64 in-in-in SNCiii in-in ActLoopNT-in 2.7746 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.72, 116.63 APE9-dihe-in -97.44, 150.89 APE8-dihe-in -77.79, 91.0 APE8-rot-na 32.15 APE67-dihe-in -73.22, -2.71 -60.01, -35.33 APE12-dist-na 9.3264 APE11-dist-na 10.7827 APE10-dist-na 11.7277 APE9-dist-in 6.9767 None None None XRAY 1.7 0.209 0.244 B 294.0 291.0 0 31 31 0 [[521, 779], [822, 1097]] 2.0 6gl9 TYR_JAK3-2_HUMAN TYR 4e-80 274.8 1.0 260.0 260.0 966 967 968 970 972 855 871 875 946 948 947 949.0 1009 997 992 991 990 989 988 987 986 903 Tyrosine-protein kinase JAK3

Ligand: F3W

Total number of chains: 2
Active chains: 2
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 2 100.0% 6GL9A
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
TYR JAK3-2 JAK3_HUMAN 6GL9A P52333 812 1103 1124.0 F3W:1201 Type1 Active DFGin 6.2475 14.0115 BLAminus -125.6, -168.17 49.24, 81.71 -98.97, 21.2 279.85, 75.03 -60.06, -26.17 in-in in 7.7934 Saltbr-in 2.6834 HRD-in -78.49, -49.26 75.45, 0.4 in-in-in SNCiii in-in ActLoopNT-in 2.7882 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -77.67, 117.53 APE9-dihe-in -98.8, 151.13 APE8-dihe-in -79.69, 90.74 APE8-rot-na 31.23 APE67-dihe-in -78.37, -0.16 -59.8, -32.45 APE12-dist-na 9.3301 APE11-dist-na 10.7633 APE10-dist-na 11.753 APE9-dist-in 6.9787 None None None XRAY 1.7 0.209 0.244 A 294.0 292.0 0 31 31 0 [[521, 779], [822, 1097]] 2.0 6gl9 Homo sapiens TYR_JAK3-2_HUMAN TYR 4e-80 274.8 1.0 260.0 260.0 966 967 968 970 972 855 871 875 946 948 947 949.0 1009 997 992 991 990 989 988 987 986 903 Tyrosine-protein kinase JAK3
TYR JAK3-2 JAK3_HUMAN 6GL9B P52333 813 1103 1124.0 F3W:1201 Type1 Active DFGin 6.21 14.019 BLAminus -123.31, -164.34 42.61, 83.03 -97.02, 22.96 280.36, 70.4 -63.87, -26.0 in-in in 7.7595 Saltbr-in 2.667 HRD-in -78.77, -47.46 73.56, 0.64 in-in-in SNCiii in-in ActLoopNT-in 2.7746 ActLoopCT-in TYR APEdihe_iiiai APEdist_aaai APE10-dihe-in -76.72, 116.63 APE9-dihe-in -97.44, 150.89 APE8-dihe-in -77.79, 91.0 APE8-rot-na 32.15 APE67-dihe-in -73.22, -2.71 -60.01, -35.33 APE12-dist-na 9.3264 APE11-dist-na 10.7827 APE10-dist-na 11.7277 APE9-dist-in 6.9767 None None None XRAY 1.7 0.209 0.244 B 294.0 291.0 0 31 31 0 [[521, 779], [822, 1097]] 2.0 6gl9 Homo sapiens TYR_JAK3-2_HUMAN TYR 4e-80 274.8 1.0 260.0 260.0 966 967 968 970 972 855 871 875 946 948 947 949.0 1009 997 992 991 990 989 988 987 986 903 Tyrosine-protein kinase JAK3

Ligand: F3W

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