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PDBsum entry 1nes
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Hydrolase/hydrolase inhibitor
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PDB id
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1nes
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Contents |
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* Residue conservation analysis
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References listed in PDB file
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Key reference
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Title
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Structure of the product complex of acetyl-Ala-Pro-Ala with porcine pancreatic elastase at 1.65 a resolution.
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Authors
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E.F.Meyer,
R.Radhakrishnan,
G.M.Cole,
L.G.Presta.
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Ref.
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J Mol Biol, 1986,
189,
533-539.
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PubMed id
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Abstract
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A single crystal of porcine pancreatic elastase was mounted in a thin-walled
capillary and allowed to react with acetyl-Ala-Pro-Ala-paranitroanalide.
Diffraction data to 1.65 A resolution were measured and the isomorphous
structure was solved from the difference Fourier map. The structure contains two
surprises. Two molecules of the product: acetyl-Ala-Pro-Ala molecule are bound
in the extended binding site. Both molecules are bound backwards with respect to
the established mode of peptide binding.
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Secondary reference #1
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Title
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Misbehaving macromolecules: backwards binding ligands and other surprising structures
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Authors
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E.F.Meyer,
I.Botos,
L.Scapozza,
D.Zhang.
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Ref.
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TO BE PUBLISHED ...
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Secondary reference #2
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Title
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Effect of the 7-Amino substituent on the inhibitory potency of mechanism-Based isocoumarin inhibitors for porcine pancreatic and human neutrophil elastases: a 1.85-A X-Ray structure of the complex between porcine pancreatic elastase and 7-[(N-Tosylphenylalanyl)amino]-4-Chloro-3- Methoxyisocoumarin.
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Authors
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M.A.Hernandez,
J.C.Powers,
J.Glinski,
J.Oleksyszyn,
J.Vijayalakshmi,
E.F.Meyer.
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Ref.
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J Med Chem, 1992,
35,
1121-1129.
[DOI no: ]
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PubMed id
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Secondary reference #3
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Title
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Structural study of porcine pancreatic elastase complexed with 7-Amino-3-(2-Bromoethoxy)-4-Chloroisocoumarin as a nonreactivatable doubly covalent enzyme-Inhibitor complex.
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Authors
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J.Vijayalakshmi,
E.F.Meyer,
C.M.Kam,
J.C.Powers.
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Ref.
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Biochemistry, 1991,
30,
2175-2183.
[DOI no: ]
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PubMed id
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Secondary reference #4
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Title
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Reaction of porcine pancreatic elastase with 7-Substituted 3-Alkoxy-4-Chloroisocoumarins: design of potent inhibitors using the crystal structure of the complex formed with 4-Chloro-3-Ethoxy-7-Guanidinoisocoumarin.
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Authors
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J.C.Powers,
J.Oleksyszyn,
S.L.Narasimhan,
C.M.Kam.
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Ref.
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Biochemistry, 1990,
29,
3108-3118.
[DOI no: ]
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PubMed id
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Secondary reference #5
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Title
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The 2.2-Angstrom resolution X-Ray crystal structure of the complex of trypsin inhibited by 4-Chloro-3-Ethoxy-7-Guanidinoisocoumarin: a proposed model of the thrombin-Inhibitor complex
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Authors
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M.M.Chow,
E.F.Meyer junior,
W.Bode,
C.-M.Kam,
R.Radhakrishnan,
J.Vijayalakshmi,
J.C.Powers.
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Ref.
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j am chem soc, 1990,
112,
7783.
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Secondary reference #6
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Title
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Human leukocyte and porcine pancreatic elastase: X-Ray crystal structures, Mechanism, Substrate specificity, And mechanism-Based inhibitors.
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Authors
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W.Bode,
E.Meyer,
J.C.Powers.
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Ref.
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Biochemistry, 1989,
28,
1951-1963.
[DOI no: ]
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PubMed id
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Secondary reference #7
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Title
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Structure of native porcine pancreatic elastase at 1.65 a resolutions.
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Authors
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E.Meyer,
G.Cole,
R.Radhakrishnan,
O.Epp.
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Ref.
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Acta Crystallogr B, 1988,
44,
26-38.
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PubMed id
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Secondary reference #8
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Title
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Crystal structures of the complex of porcine pancreatic elastase with two valine-Derived benzoxazinone inhibitors.
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Authors
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R.Radhakrishnan,
L.G.Presta,
E.F.Meyer,
R.Wildonger.
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Ref.
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J Mol Biol, 1987,
198,
417-424.
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PubMed id
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Secondary reference #9
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Title
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Crystal structures of the complex of porcine pancreatic elastase with two valine-Derived benzoxazinone inhibitors.
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Authors
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R.Radhakrishnan,
L.G.Presta,
E.F.Meyer,
R.Wildonger.
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Ref.
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J Mol Biol, 1987,
198,
417-424.
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PubMed id
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Secondary reference #10
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Title
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Stereospecific reaction of 3-Methoxy-4-Chloro-7-Amino-Isocoumarin with crystalline porcine pancreatic elastase
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Authors
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E.F.Meyer junior,
L.G.Presta,
R.Radhakrishnan.
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Ref.
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j am chem soc, 1985,
107,
4091.
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