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5OZ7	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 18 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.608 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ6	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 17 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.546 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ5	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 16 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (1.485 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ4	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 15 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.478 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ3	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 14 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.754 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ2	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 13 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.61 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ1	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 12 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-16 Method: X-RAY DIFFRACTION (1.478 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OZ0	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 11 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.449 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYZ	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 10 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.487 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYY	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 9 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.447 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYX	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 8 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (1.654 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYW	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 7 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.483 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYV	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 6 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (1.439 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYU	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 5 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.25 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYT	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 4 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2021-11-17 Method: X-RAY DIFFRACTION (1.589 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYS	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 3 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.649 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYR	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 2 Descriptor: endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (1.488 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OYQ	Automated refinement of diffraction data obtained from an endothiapepsin crystal treated with fragment 1 Descriptor: Endothiapepsin Authors: Schiebel, J, Heine, A, Klebe, G. Deposit date: 2016-06-28 Release date: 2016-08-03 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.49 Å) Cite: High-Throughput Crystallography: Reliable and Efficient Identification of Fragment Hits. Structure, 24, 2016
5OJE	Endothiapepsin with Ligand VSK-B24 Descriptor: (2~{S})-2-azanyl-3-(1~{H}-indol-3-yl)-~{N}-[2-(2,4,6-trimethylphenyl)ethyl]propanamide, DIMETHYL SULFOXIDE, Endothiapepsin, ... Authors: Gierse, R.M, Magari, F, Groves, M.R, Heine, A, Klebe, G, Hirsch, A. Deposit date: 2017-07-21 Release date: 2018-09-12 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.579 Å) Cite: Design and Synthesis of Bioisosteres of Acylhydrazones as Stable Inhibitors of the Aspartic Protease Endothiapepsin. ChemMedChem, 13, 2018
5OG7	Endothiapepsin in complex with hydrazide fragment Descriptor: 3-chloranyl-~{N}'-(4,5-dihydro-1~{H}-imidazol-3-ium-2-yl)propanehydrazide, DIMETHYL SULFOXIDE, Endothiapepsin Authors: Metz, A, Klauser, P.C, Heine, A, Klebe, G. Deposit date: 2017-07-12 Release date: 2018-08-08 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (1.823 Å) Cite: Endothiapepsin in complex with hydrazide fragment To Be Published
5NFG	Structure of recombinant cardosin B from Cynara cardunculus Descriptor: Procardosin-B,Procardosin-B, alpha-D-mannopyranose-(1-2)-[alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose Authors: Pereira, P.J.B, Figueiredo, A.C, Manso, J.A, Almeida, C.M, Simoes, I. Deposit date: 2017-03-14 Release date: 2017-10-11 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (2.375 Å) Cite: Functional and structural characterization of synthetic cardosin B-derived rennet. Appl. Microbiol. Biotechnol., 101, 2017
5N7Q	CRYSTAL STRUCTURE OF MATURE CATHEPSIN D FROM THE TICK IXODES RICINUS (IRCD1) IN COMPLEX WITH THE INHIBITOR PEPSTATIN A Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, PEPSTATIN A, ... Authors: Brynda, J, Hanova, I, Hobizalova, R, Mares, M. Deposit date: 2017-02-21 Release date: 2017-12-27 Last modified: 2018-06-13 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Novel Structural Mechanism of Allosteric Regulation of Aspartic Peptidases via an Evolutionarily Conserved Exosite. Cell Chem Biol, 25, 2018
5N7N	CRYSTAL STRUCTURE OF CATHEPSIN D ZYMOGEN FROM THE TICK IXODES RICINUS (IRCD1) Descriptor: AMMONIUM ION, Putative cathepsin d, SULFATE ION Authors: Brynda, J, Hanova, I, Hobizalova, R, Mares, M. Deposit date: 2017-02-21 Release date: 2017-12-27 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Novel Structural Mechanism of Allosteric Regulation of Aspartic Peptidases via an Evolutionarily Conserved Exosite. Cell Chem Biol, 25, 2018
5N71	CRYSTAL STRUCTURE OF MATURE CATHEPSIN D FROM THE TICK IXODES RICINUS (IRCD1) Descriptor: DI(HYDROXYETHYL)ETHER, Putative cathepsin d, SULFATE ION Authors: Brynda, J, Hanova, I, Hobizalova, R, Mares, M. Deposit date: 2017-02-17 Release date: 2017-12-27 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (1.88 Å) Cite: Novel Structural Mechanism of Allosteric Regulation of Aspartic Peptidases via an Evolutionarily Conserved Exosite. Cell Chem Biol, 25, 2018
5N70	CRYSTAL STRUCTURE OF MATURE CATHEPSIN D FROM THE TICK IXODES RICINUS (IRCD1) IN COMPLEX WITH THE N-TERMINAL OCTAPEPTIDE OF THE PROPEPTID Descriptor: ALA-PHE-ARG-ILE-PRO-LEU-THR-ARG, Putative cathepsin d Authors: Brynda, J, Hanova, I, Hobizalova, R, Mares, M. Deposit date: 2017-02-17 Release date: 2017-12-27 Last modified: 2018-03-28 Method: X-RAY DIFFRACTION (1.81 Å) Cite: Novel Structural Mechanism of Allosteric Regulation of Aspartic Peptidases via an Evolutionarily Conserved Exosite. Cell Chem Biol, 25, 2018

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