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6R11	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 5b Descriptor: 5-azanyl-2-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]isoindole-1,3-dione, CHLORIDE ION, Cereblon isoform 4, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-13 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.75 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R13	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 7f Descriptor: CHLORIDE ION, Cereblon isoform 4, PHOSPHATE ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-13 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.65 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R12	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 7b Descriptor: CHLORIDE ION, Cereblon isoform 4, PHOSPHATE ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-13 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.74 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R18	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 11a Descriptor: CHLORIDE ION, Cereblon isoform 4, PHOSPHATE ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.35 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R19	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 20a Descriptor: Cereblon isoform 4, PHOSPHATE ION, S-Thalidomide, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.45 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1A	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 20b Descriptor: Cereblon isoform 4, PHOSPHATE ION, S-Thalidomide, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.54 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1D	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 7d, co-crystallized Descriptor: (phenylmethyl) ~{N}-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]carbamate, Cereblon isoform 4, ZINC ION Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.1 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1K	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 7c Descriptor: Cereblon isoform 4, PHOSPHATE ION, ZINC ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.94 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1W	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 16b Descriptor: (4-azanylcyclohexyl)methyl ~{N}-[(3~{S})-2,6-bis(oxidanylidene)piperidin-3-yl]carbamate, Cereblon isoform 4, PHOSPHATE ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-15 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.35 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1X	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 7a Descriptor: Cereblon isoform 4, ZINC ION, ~{N}-[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-methyl-but-2-enamide Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-15 Release date: 2019-08-07 Last modified: 2024-05-15 Method: X-RAY DIFFRACTION (1.8 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
6R1C	Cereblon isoform 4 from Magnetospirillum gryphiswaldense in complex with compound 12a Descriptor: 4-[[4-[[(3~{S})-2,5-bis(oxidanylidene)pyrrolidin-3-yl]carbamoyloxymethyl]phenyl]methylamino]-4-oxidanylidene-butanoic acid, ASPARTIC ACID, CHLORIDE ION, ... Authors: Heim, C, Hartmann, M.D. Deposit date: 2019-03-14 Release date: 2019-08-07 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.5 Å) Cite: De-Novo Design of Cereblon (CRBN) Effectors Guided by Natural Hydrolysis Products of Thalidomide Derivatives. J.Med.Chem., 62, 2019
1C3T	ROTAMER STRAIN AS A DETERMINANT OF PROTEIN STRUCTURAL SPECIFICITY Descriptor: PROTEIN (1D8 UBIQUITIN) Authors: Lazar, G.A, Johnson, E.C, Desjarlais, J.R, Handel, T.M. Deposit date: 1999-07-28 Release date: 1999-08-20 Last modified: 2024-04-10 Method: SOLUTION NMR Cite: Rotamer strain as a determinant of protein structural specificity. Protein Sci., 8, 1999
5SWK	Crystal structure of p53 epitope-scaffold based on a inhibitor of cysteine proteases in complex with human MDM2 Descriptor: CHLORIDE ION, De novo protein based on the inhibitor Amoebiasin-1, E3 ubiquitin-protein ligase Mdm2, ... Authors: Jimenez-Sandoval, P, Brieba, L.G. Deposit date: 2016-08-08 Release date: 2017-10-18 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.923 Å) Cite: Mimicking a p53-MDM2 interaction based on a stable immunoglobulin-like domain scaffold. Proteins, 86, 2018
1VL3	DESIGN OF NEW MIMOCHROMES WITH UNIQUE TOPOLOGY Descriptor: CO(III)-(DEUTEROPORPHYRIN IX), GLU-SER-GLN-LEU-HIS-SER-ASN-LYS-ARG Authors: Lombardi, A, Nastri, F, Marasco, D, Maglio, O, De Sanctis, G, Sinibaldi, F, Santucci, R, Coletta, M, Pavone, V. Deposit date: 2004-07-05 Release date: 2004-07-20 Last modified: 2023-12-27 Method: SOLUTION NMR Cite: Design of a New Mimochrome with Unique Topology. Chemistry, 9, 2003
7PWY	Structure of human dimeric ACMSD in complex with the inhibitor TES-1025 Descriptor: 2-[3-[(5-cyano-6-oxidanylidene-4-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanylmethyl]phenyl]ethanoic acid, 2-amino-3-carboxymuconate-6-semialdehyde decarboxylase, POTASSIUM ION, ... Authors: Cianci, M, Giacche, N, Carotti, A, Liscio, P, Amici, A, Cialabrini, L, De Franco, F, Pellicciari, R, Raffaelli, N. Deposit date: 2021-10-07 Release date: 2022-04-20 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Structural Basis of Human Dimeric alpha-Amino-beta-Carboxymuconate-epsilon-Semialdehyde Decarboxylase Inhibition With TES-1025. Front Mol Biosci, 9, 2022
1KVF	EMP-18 Erythropoietin Receptor Agonist Peptide Descriptor: PROTEIN: EMP-18 Receptor Agonist Authors: Skelton, N.J, Russell, S, de Sauvage, F, Cochran, A.G. Deposit date: 2002-01-25 Release date: 2002-03-06 Last modified: 2022-02-23 Method: SOLUTION NMR Cite: Amino acid determinants of beta-hairpin conformation in erythropoeitin receptor agonist peptides derived from a phage display library J.Mol.Biol., 316, 2002
1KVG	EPO-3 beta Hairpin Peptide Descriptor: Protein: EPO-3 Receptor Agonist Authors: Skelton, N.J, Russell, S, de Sauvage, F, Cochran, A.G. Deposit date: 2002-01-25 Release date: 2002-03-06 Last modified: 2022-02-23 Method: SOLUTION NMR Cite: Amino Acid Determinants of beta-Hairpin Conformation in Erythropoeitin Receptor Agonist Peptides Derived from a Phage Display Library J.Mol.Biol., 316, 2002
1AO0	GLUTAMINE PHOSPHORIBOSYLPYROPHOSPHATE (PRPP) AMIDOTRANSFERASE FROM B. SUBTILIS COMPLEXED WITH ADP AND GMP Descriptor: ADENOSINE-5'-DIPHOSPHATE, GLUTAMINE PHOSPHORIBOSYLPYROPHOSPHATE AMIDOTRANSFERASE, GUANOSINE-5'-MONOPHOSPHATE, ... Authors: Tomchick, D.R, Smith, J.L. Deposit date: 1997-07-15 Release date: 1997-11-12 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Mechanism of the synergistic end-product regulation of Bacillus subtilis glutamine phosphoribosylpyrophosphate amidotransferase by nucleotides. Biochemistry, 36, 1997
1GX5	Hepatitis C Virus RNA Polymerase in Complex with GTP and Manganese Descriptor: GUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, RNA-DIRECTED RNA POLYMERASE Authors: Bressanelli, S, Rey, F.A. Deposit date: 2002-03-27 Release date: 2002-04-09 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (1.7 Å) Cite: A Structural Analysis of the Hepatitis C Virus RNA Polymerase in Complex with Ribonucleotides J.Virol., 76, 2002
1GX6	Hepatitis C Virus RNA polymerase in complex with UTP and manganese Descriptor: MANGANESE (II) ION, RNA-DIRECTED RNA POLYMERASE, URIDINE 5'-TRIPHOSPHATE Authors: Bressanelli, S, Rey, F.A. Deposit date: 2002-03-27 Release date: 2002-04-10 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (1.85 Å) Cite: A Structural Analysis of the Hepatitis C Virus RNA Polymerase in Complex with Ribonucleotides J.Virol., 76, 2002
6F0Q	Crystal structure of Pizza6-AYW Descriptor: Pizza6-AYW Authors: Noguchi, H, De Zitter, E, Van Meervelt, L, Voet, A.R.D. Deposit date: 2017-11-20 Release date: 2018-03-21 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Design of tryptophan-containing mutants of the symmetrical Pizza protein for biophysical studies. Biochem. Biophys. Res. Commun., 497, 2018
6F0S	Crystal structure of Pizza6-SYW Descriptor: Pizza6-SYW Authors: Noguchi, H, De Zitter, E, Van Meervelt, L, Voet, A.R.D. Deposit date: 2017-11-20 Release date: 2018-03-21 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Design of tryptophan-containing mutants of the symmetrical Pizza protein for biophysical studies. Biochem. Biophys. Res. Commun., 497, 2018
6F0T	Crystal structure of Pizza6-SFW Descriptor: GLYCEROL, Pizza6-SFW Authors: Noguchi, H, De Zitter, E, Van Meervelt, L, Voet, A.R.D. Deposit date: 2017-11-20 Release date: 2018-03-21 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (1.74 Å) Cite: Design of tryptophan-containing mutants of the symmetrical Pizza protein for biophysical studies. Biochem. Biophys. Res. Commun., 497, 2018
6NBR	Crystal Structure of Piper methysticum Kavalactone Reductase 1 in complex with NADP Descriptor: Kavalactone reductase 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Pluskal, T, Weng, J.K. Deposit date: 2018-12-09 Release date: 2019-06-19 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.8 Å) Cite: The biosynthetic origin of psychoactive kavalactones in kava. Nat.Plants, 5, 2019
6OP5	Crystal Structure of Piper methysticum Styrylpyrone Synthase 1 in complex with p-coumaroyl-CoA Descriptor: Styrylpyrone synthase 1, p-coumaroyl-CoA Authors: Pluskal, T, Weng, J.K. Deposit date: 2019-04-24 Release date: 2019-06-12 Last modified: 2019-08-21 Method: X-RAY DIFFRACTION (2.7 Å) Cite: The biosynthetic origin of psychoactive kavalactones in kava. Nat.Plants, 5, 2019

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