Ligand: AQG

Total number of chains: 4
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin None 3 75.0% 8EX0A
DFGin BLAminus 1 25.0% 6JGMA

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
CMGC CDK2 CDK2_HUMAN 6JGMA 2.3 Inactive DFGin‑BLAminus out-out none-out nonTYR APEdihe_aaiii APEdist_nnno AQG Type1 1 - 298 0 None None Cyclin-dependent kinase 2
TYR JAK2-1 JAK2_HUMAN 8B8NA 2.0 Pseudo DFGin‑None out-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 809 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2
TYR JAK2-1 JAK2_HUMAN 5WIJA 2.04 Pseudo DFGin‑None in-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 809 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2
TYR JAK2-1 JAK2_HUMAN 8EX0A 1.85 Pseudo DFGin‑None in-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 808 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2

Ligand: AQG

Total number of chains: 4
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin None 3 75.0% 8EX0A
DFGin BLAminus 1 25.0% 6JGMA

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
CMGC CDK2 CDK2_HUMAN 6JGMA 2.3 Inactive DFGin‑BLAminus out-out none-out nonTYR APEdihe_aaiii APEdist_nnno AQG Type1 1 - 298 0 None None Cyclin-dependent kinase 2 Homo sapiens
TYR JAK2-1 JAK2_HUMAN 8B8NA 2.0 Pseudo DFGin‑None out-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 809 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2 Homo sapiens
TYR JAK2-1 JAK2_HUMAN 5WIJA 2.04 Pseudo DFGin‑None in-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 809 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2 Homo sapiens
TYR JAK2-1 JAK2_HUMAN 8EX0A 1.85 Pseudo DFGin‑None in-na out-out TYR APEdihe_oooao APEdist_aaao AQG Type1 536 - 808 0 None W659A,W777A,F794H Tyrosine-protein kinase JAK2 Homo sapiens

Ligand: AQG

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

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism