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PDBsum entry 3vfe
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PDB id:
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Hydrolase
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Title:
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Virtual screening and x-ray crystallography for human kallikrein 6 inhibitors with an amidinothiophene p1 group
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Structure:
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Kallikrein-6. Chain: a. Fragment: hk6 chain a. Synonym: neurosin, protease m, sp59, serine protease 18, serine protease 9, zyme. Engineered: yes. Mutation: yes
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Source:
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Homo sapiens. Human. Organism_taxid: 9606. Gene: klk6, prss18, prss9. Expressed in: spodoptera frugiperda. Expression_system_taxid: 7108. Expression_system_cell_line: sf9
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Resolution:
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1.88Å
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R-factor:
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0.195
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R-free:
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0.223
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Authors:
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X.Chen,Y.Zhang,T.Xia,R.Wang
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Key ref:
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G.Liang
et al.
(2012).
Human kallikrein 6 inhibitors with a para-amidobenzylanmine P1 group identified through virtual screening.
Bioorg Med Chem Lett,
22,
2450-2455.
PubMed id:
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Date:
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09-Jan-12
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Release date:
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21-Nov-12
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PROCHECK
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Headers
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References
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Q92876
(KLK6_HUMAN) -
Kallikrein-6 from Homo sapiens
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Seq:
Struc:
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244 a.a.
222 a.a.*
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Key: |
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PfamA domain |
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Secondary structure |
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CATH domain |
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*
PDB and UniProt seqs differ
at 3 residue positions (black
crosses)
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Bioorg Med Chem Lett
22:2450-2455
(2012)
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PubMed id:
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Human kallikrein 6 inhibitors with a para-amidobenzylanmine P1 group identified through virtual screening.
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G.Liang,
X.Chen,
S.Aldous,
S.F.Pu,
S.Mehdi,
E.Powers,
T.Xia,
R.Wang.
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ABSTRACT
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Links
