PDB: 4050 resultsInfo pagesStatus searchChemie searchBIRD

---

1XUH	TRYPSIN-KETO-BABIM-CO+2, PH 8.2 Descriptor: BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANONE, CALCIUM ION, COBALT (II) ION, ... Authors: Katz, B.A, Clark, J.M, Finer-Moore, J.S, Jenkins, T.E, Johnson, C.R, Rose, M.J, Luong, C, Moore, W.R, Stroud, R.M. Deposit date: 1997-10-10 Release date: 1998-11-11 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1XUF	TRYPSIN-BABIM-ZN+2, PH 8.2 Descriptor: BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANE ZINC, CALCIUM ION, TRYPSIN Authors: Katz, B.A, Clark, J.M, Finer-Moore, J.S, Jenkins, T.E, Johnson, C.R, Rose, M.J, Luong, C, Moore, W.R, Stroud, R.M. Deposit date: 1997-10-10 Release date: 1998-12-16 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1XUG	TRYPSIN-BABIM-ZN+2, PH 8.2 Descriptor: BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANE, CALCIUM ION, TRYPSIN, ... Authors: Katz, B.A, Clark, J.M, Finer-Moore, J.S, Jenkins, T.E, Johnson, C.R, Rose, M.J, Luong, C, Moore, W.R, Stroud, R.M. Deposit date: 1997-10-10 Release date: 1998-12-16 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1XUK	TRYPSIN-BABIM-SULFATE, PH 5.9 Descriptor: BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANE, CALCIUM ION, SULFATE ION, ... Authors: Katz, B.A, Clark, J.M, Finer-Moore, J.S, Jenkins, T.E, Johnson, C.R, Rose, M.J, Luong, C, Moore, W.R, Stroud, R.M. Deposit date: 1997-10-10 Release date: 1998-11-11 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1XUI	TRYPSIN-KETO-BABIM, ZN+2-FREE, PH 8.2 Descriptor: BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANONE, CALCIUM ION, SODIUM ION, ... Authors: Katz, B.A, Clark, J.M, Finer-Moore, J.S, Jenkins, T.E, Johnson, C.R, Rose, M.J, Luong, C, Moore, W.R, Stroud, R.M. Deposit date: 1997-10-10 Release date: 1998-11-11 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
2IT7	Solution structure of the squash trypsin inhibitor EETI-II Descriptor: Trypsin inhibitor 2 Authors: Chiche, L, Heitz, A, Le-Nguyen, D. Deposit date: 2006-10-19 Release date: 2007-10-02 Last modified: 2022-03-09 Method: SOLUTION NMR Cite: Knottin cyclization: Structure and stability of cyclic and linear squash inhibitors do not differ significantly To be Published
3I2X	Crystal structure of a chimeric trypsin inhibitor having reactive site loop of ETI on the scaffold of WCI Descriptor: Chymotrypsin inhibitor 3 Authors: Sen, U, Khamrui, S, Dasgupta, J, Dattagupta, J.K, Majumder, S. Deposit date: 2009-06-30 Release date: 2010-02-02 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.85 Å) Cite: Identification of a novel set of scaffolding residues that are instrumental for the inhibitory property of Kunitz (STI) inhibitors. Protein Sci., 19, 2010
3QYD	Crystal structure of a recombinant chimeric trypsin inhibitor Descriptor: Chymotrypsin inhibitor 3 Authors: Sen, U, Majumder, S, Khamrui, S, Dasgupta, J. Deposit date: 2011-03-03 Release date: 2011-05-25 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.97 Å) Cite: Role of remote scaffolding residues in the inhibitory loop pre-organization, flexibility, rigidification and enzyme inhibition of serine protease inhibitors Biochim.Biophys.Acta, 1824, 2012
1EJM	CRYSTAL STRUCTURE OF THE BPTI ALA16LEU MUTANT IN COMPLEX WITH BOVINE TRYPSIN Descriptor: BETA-TRYPSIN, PANCREATIC TRYPSIN INHIBITOR, SULFATE ION Authors: Otlewski, J, Smalas, A, Helland, R, Grzesiak, A, Krowarsch, D. Deposit date: 2000-03-03 Release date: 2001-03-03 Last modified: 2021-11-03 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Substitutions at the P(1) position in BPTI strongly affect the association energy with serine proteinases. J.Mol.Biol., 301, 2000
1GHA	A SECOND ACTIVE SITE IN CHYMOTRYPSIN? THE X-RAY CRYSTAL STRUCTURE OF N-ACETYL-D-TRYPTOPHAN BOUND TO GAMMA-CHYMOTRYPSIN Descriptor: GAMMA-CHYMOTRYPSIN A, ISOPROPYL ALCOHOL, PRO GLY VAL TYR PEPTIDE, ... Authors: Yennawar, H.P, Yennawar, N.H, Farber, G.K. Deposit date: 1994-04-06 Release date: 1994-06-22 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.2 Å) Cite: A STRUCTURAL EXPLANATION FOR ENZYME MEMORY IN NONAQUEOUS SOLVENTS. J.Am.Chem.Soc., 117, 1995
2BEA	Crystal structure of Asn14 to Gly mutant of WCI Descriptor: Chymotrypsin inhibitor 3 Authors: Dattagupta, J.K, Sen, U, Dasgupta, J, Khamrui, S. Deposit date: 2005-10-24 Release date: 2006-06-13 Last modified: 2021-10-20 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Spacer Asn Determines the Fate of Kunitz (STI) Inhibitors, as Revealed by Structural and Biochemical Studies on WCI Mutants. Biochemistry, 45, 2006
2IT8	Solution structure of a linear analog of the cyclic squash trypsin inhibitor MCoTI-II Descriptor: Trypsin inhibitor 2 Authors: Avrutina, O, Chiche, L, Diederichsen, U, Heitz, A, Kolmar, H. Deposit date: 2006-10-19 Release date: 2007-10-02 Last modified: 2014-04-02 Method: SOLUTION NMR Cite: Knottin cyclization: Structure and stability of cyclic and linear squash inhibitors do not differ significantly To be Published
1OPH	NON-COVALENT COMPLEX BETWEEN ALPHA-1-PI-PITTSBURGH AND S195A TRYPSIN Descriptor: Alpha-1-antitrypsin precursor, Trypsinogen, cationic precursor Authors: Dementiev, A, Simonovic, M, Volz, K, Gettins, P.G. Deposit date: 2003-03-05 Release date: 2003-08-05 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Canonical inhibitor-like interactions explain reactivity of alpha1-proteinase inhibitor Pittsburgh and antithrombin with proteinases J.Biol.Chem., 278, 2003
1BTX	Episelection: Novel Ki ~Nanomolar Inhibitors of Serine Proteases Selected by Binding or Chemistry on an Enzyme Surface Descriptor: BETA-TRYPSIN, CALCIUM ION, N-(tert-butoxycarbonyl)-L-alanyl-N-[(1S)-5-amino-1-(diethoxyboranyl)pentyl]-L-valinamide Authors: Stroud, R.M, Katz, B.A, Finer-Moore, J. Deposit date: 1995-05-17 Release date: 1995-10-15 Last modified: 2012-12-12 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Episelection: novel Ki approximately nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface. Biochemistry, 34, 1995
1BTZ	Episelection: novel KI ~nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface Descriptor: BETA-TRYPSIN, CALCIUM ION, N-(tert-butoxycarbonyl)-L-alanyl-N-{(1R)-5-ammonio-1-[hydroxy(methoxy)boranyl]pentyl}-L-valinamide Authors: Stroud, R.M, Katz, B.A, Finer-Moore, J. Deposit date: 1995-05-17 Release date: 1995-10-15 Last modified: 2012-12-12 Method: X-RAY DIFFRACTION (2 Å) Cite: Episelection: novel Ki approximately nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface. Biochemistry, 34, 1995
1BTW	Episelection: novel KI ~nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface Descriptor: BETA-TRYPSIN, CALCIUM ION, N-(tert-butoxycarbonyl)-L-alanyl-N-{(1S)-5-ammonio-1-[hydroxy(3-hydroxypropoxy)boranyl]pentyl}-L-valinamide Authors: Stroud, R.M, Katz, B.A, Finer-Moore, J. Deposit date: 1995-05-17 Release date: 1995-10-15 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Episelection: novel Ki approximately nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface. Biochemistry, 34, 1995
5OM7	Crystal structure of Alpha1-antichymotrypsin variant DBS-II: a drug-binding serpin for doxorubicin Descriptor: Alpha-1-antichymotrypsin, DOXORUBICIN Authors: Schmidt, K, Kern, A, Muller, Y.A. Deposit date: 2017-07-28 Release date: 2018-05-23 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (1.727 Å) Cite: Design of an allosterically modulated doxycycline and doxorubicin drug-binding protein. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6HGH	Crystal structure of Alpha1-antichymotrypsin variant NewBG-III: a new binding globulin without any bound ligand Descriptor: Alpha-1-antichymotrypsin, MALONIC ACID, alpha1-Antichymotrypsin Authors: Schmidt, K, Muller, Y.A. Deposit date: 2018-08-23 Release date: 2019-05-29 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.9 Å) Cite: NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy. J.Struct.Biol., 207, 2019
6HGE	Crystal structure of Alpha1-antichymotrypsin variant NewBG-I in the uncleaved S-conformation Descriptor: Alpha-1-antichymotrypsin Authors: Gardill, B.R, Schmidt, K, Muller, Y.A. Deposit date: 2018-08-23 Release date: 2019-05-29 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (2.8 Å) Cite: NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy. J.Struct.Biol., 207, 2019
6HGL	Crystal structure of Alpha1-antichymotrypsin variant NewBG-III: a new binding globulin in complex with testosterone Descriptor: Alpha-1-antichymotrypsin, TESTOSTERONE Authors: Schmidt, K, Muller, Y.A. Deposit date: 2018-08-23 Release date: 2019-05-29 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.92 Å) Cite: NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy. J.Struct.Biol., 207, 2019
6HGI	Crystal structure of Alpha1-antichymotrypsin variant NewBG-III: a new binding globulin in complex with corticosterone Descriptor: Alpha-1-antichymotrypsin, CORTICOSTERONE Authors: Schmidt, K, Muller, Y.A. Deposit date: 2018-08-23 Release date: 2019-05-29 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.517 Å) Cite: NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy. J.Struct.Biol., 207, 2019
6HGD	Crystal structure of Alpha1-antichymotrypsin variant NewBG-0: a new binding globulin variant that is devoid of any cortisol-binding capabilities Descriptor: Alpha-1-antichymotrypsin Authors: Gardill, B.R, Schmidt, K, Muller, Y.A. Deposit date: 2018-08-23 Release date: 2019-05-29 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.9 Å) Cite: NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy. J.Struct.Biol., 207, 2019
3NDD	Cleaved antitrypsin with P10 Pro, and P9-P6 Asp Descriptor: Alpha-1-antitrypsin Authors: Yamasaki, M, Sendall, T.J, Huntington, J.A. Deposit date: 2010-06-07 Release date: 2010-07-28 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Loop-sheet mechanism of serpin polymerization tested by reactive center loop mutations J. Biol. Chem., 285, 2010
3NDF	Cleaved antitrypsin with P8-P6 Asp Descriptor: Alpha-1-antitrypsin Authors: Huntington, J.A, Sendall, T.J, Yamasaki, M. Deposit date: 2010-06-07 Release date: 2010-07-28 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Loop-sheet mechanism of serpin polymerization tested by reactive center loop mutations J. Biol. Chem., 285, 2010
1QMB	Cleaved alpha-1-antitrypsin polymer Descriptor: ALPHA-1-ANTITRYPSIN Authors: Huntington, J.A, Pannu, N.S, Hazes, B, Read, R.J, Lomas, D.A, Carrell, R.W. Deposit date: 1999-09-24 Release date: 2000-02-06 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.6 Å) Cite: A 2.6A Structure of a Serpin Polymer and Implications for Conformational Disease J.Mol.Biol., 293, 1999

<22232425262728293031323334353637>