Ligand: RQE

Total number of chains: 3
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin None 2 66.7% 8BU6B
DFGin BLAminus 1 33.3% 8BU6E

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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 CDK12 CDK12_HUMAN 8BU6E 3.45 Inactive DFGin‑BLAminus in-out in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1038 0 TPO893 K965R Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 8BU6B 3.45 Inactive DFGin‑None in-in in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1039 0 TPO893 K965R Cyclin-dependent kinase 12
CMGC CDK12 CDK12_HUMAN 8BU6H 3.45 Inactive DFGin‑None in-out in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1038 0 TPO893 K965R Cyclin-dependent kinase 12

Ligand: RQE

Total number of chains: 3
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin None 2 66.7% 8BU6B
DFGin BLAminus 1 33.3% 8BU6E

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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 CDK12 CDK12_HUMAN 8BU6E 3.45 Inactive DFGin‑BLAminus in-out in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1038 0 TPO893 K965R Cyclin-dependent kinase 12 Homo sapiens
CMGC CDK12 CDK12_HUMAN 8BU6B 3.45 Inactive DFGin‑None in-in in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1039 0 TPO893 K965R Cyclin-dependent kinase 12 Homo sapiens
CMGC CDK12 CDK12_HUMAN 8BU6H 3.45 Inactive DFGin‑None in-out in-out nonTYR APEdihe_aaioi APEdist_iiii RQE Type1 715 - 1038 0 TPO893 K965R Cyclin-dependent kinase 12 Homo sapiens

Ligand: RQE

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