Ligand: 5FI

Total number of chains: 8
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 6 75.0% 4L3JA
DFGin BLAminus 2 25.0% 4L44A

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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
AGC RPS6KB1 KS6B1_HUMAN 4L3JA 2.1 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 375 0 None None Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L3LA 2.1 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 375 0 None None Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 3WE4A 1.995 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 374 0 TPO252 None Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L45A 2.9 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaiii APEdist_nnno 5FI Type1 81 - 417 0 None T412E Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L42A 2.8 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iioo 5FI Type1 84 - 417 0 None S403E,A404E,N405Q,Q406E,V407M,L409R,G410D,T412E,V414I,P416D,S417W Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L46A 3.01 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 80 - 417 0 TPO412 None Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L43A 3.0 Inactive DFGin‑BLAminus in-in out-out nonTYR APEdihe_aaiii APEdist_nnno 5FI Type1 81 - 417 0 None T412A Ribosomal protein S6 kinase beta-1
AGC RPS6KB1 KS6B1_HUMAN 4L44A 2.9 Inactive DFGin‑BLAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 81 - 417 0 None T412A Ribosomal protein S6 kinase beta-1

Ligand: 5FI

Total number of chains: 8
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin ABAminus 6 75.0% 4L3JA
DFGin BLAminus 2 25.0% 4L44A

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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
AGC RPS6KB1 KS6B1_HUMAN 4L3JA 2.1 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 375 0 None None Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L3LA 2.1 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 375 0 None None Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 3WE4A 1.995 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 85 - 374 0 TPO252 None Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L45A 2.9 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaiii APEdist_nnno 5FI Type1 81 - 417 0 None T412E Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L42A 2.8 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iioo 5FI Type1 84 - 417 0 None S403E,A404E,N405Q,Q406E,V407M,L409R,G410D,T412E,V414I,P416D,S417W Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L46A 3.01 Inactive DFGin‑ABAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 80 - 417 0 TPO412 None Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L43A 3.0 Inactive DFGin‑BLAminus in-in out-out nonTYR APEdihe_aaiii APEdist_nnno 5FI Type1 81 - 417 0 None T412A Ribosomal protein S6 kinase beta-1 Homo sapiens
AGC RPS6KB1 KS6B1_HUMAN 4L44A 2.9 Inactive DFGin‑BLAminus in-in out-out nonTYR APEdihe_aaioi APEdist_iooo 5FI Type1 81 - 417 0 None T412A Ribosomal protein S6 kinase beta-1 Homo sapiens

Ligand: 5FI

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