PDB entry 6k9u

View 6k9u on RCSB PDB site
Description: Discovery of Pyrazolo[1,5-a]pyrimidine Derivative as a Highly Selective PDE10A Inhibitor
Class: hydrolase
Keywords: Enzyme, PDE, BBB, brain penetration, crystatl structure, inhibitor, schizophrenia, HYDROLASE
Deposited on 2019-06-18, released 2019-07-17
The last revision prior to the SCOPe 2.08 freeze date was dated 2019-08-07, with a file datestamp of 2019-08-02.
Experiment type: XRAY
Resolution: 2.35 Å
R-factor: N/A
AEROSPACI score: 0.24 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
    Species: Rattus norvegicus [TaxId:10116]
    Gene: PDE10A
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d6k9ua_
  • Heterogens: D4L, ZN, MG, SO4, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >6k9uA (A:)
gspnlparicrdielfhfdigpfenmwpgifvymihrscgtscfeleklcrfimsvkkny
rrvpyhnwkhavtvahcmyailqnnnglftdlerkglliaclchdldhrgfsnsylqkfd
hplaalyststmeqhhfsqtvsilqleghnifstlssseyeqvleiirkaiiatdlalyf
gnrkqleemyqtgslnlhnqshrdrviglmmtacdlcsvtklwpvtkltandiyaefwae
gdemkklgiqpipmmdrdkrdevpqgqlgfynavaipcyttltqilpptepllkacrdnl
nqwekvirgee

    Sequence, based on observed residues (ATOM records): (download) 
    >6k9uA (A:)
lparicrdielfhfdigpfenmwpgifvymihrsfeleklcrfimsvkknyrrvpyhnwk
havtvahcmyailqnnnglftdlerkglliaclchdldhrgfsnsylqkfdhplaalyst
stmeqhhfsqtvsilqleghnifstlssseyeqvleiirkaiiatdlalyfgnrkqleem
yqtgslnlhnqshrdrviglmmtacdlcsvtklwpvtkltandiyaefwaegdemkklgi
qpipmmdrdkrdevpqgqlgfynavaipcyttltqilpptepllkacrdnlnqwekvirg
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