PDB: 98041 resultsInfo pagesStatus searchChemie searchBIRD

---

5KNM	Human leukocyte antigen F (HLA-F) presents peptides and regulates immunity through interactions with NK-cell receptors Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Beta-2-microglobulin, Leukocyte immunoglobulin-like receptor subfamily B member 1, ... Authors: Dulberger, C.L, Adams, E.J. Deposit date: 2016-06-28 Release date: 2017-06-14 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Human Leukocyte Antigen F Presents Peptides and Regulates Immunity through Interactions with NK Cell Receptors. Immunity, 46, 2017
1H80	1,3-ALPHA-1,4-BETA-D-GALACTOSE-4-SULFATE- 3,6-ANHYDRO-D-GALACTOSE-2-SULFATE 4 GALACTOHYDROLASE Descriptor: CALCIUM ION, CHLORIDE ION, GLYCEROL, ... Authors: Michel, G, Chantalat, L, Dideberg, O. Deposit date: 2001-01-22 Release date: 2001-11-27 Last modified: 2018-10-24 Method: X-RAY DIFFRACTION (1.6 Å) Cite: The Iota-Carrageenase of Alteromonas Fortis. A Beta-Helix Fold-Containing Enzyme for the Degradation of a Highly Polyanionic Polysaccharide J.Biol.Chem., 276, 2001
2HIS	CELLULOMONAS FIMI XYLANASE/CELLULASE DOUBLE MUTANT E127A/H205N WITH COVALENT CELLOBIOSE Descriptor: CELLULOMONAS FIMI FAMILY 10 BETA-1,4-GLYCANASE, beta-D-glucopyranose-(1-4)-alpha-D-glucopyranose Authors: Notenboom, V, Birsan, C, Nitz, M, Rose, D.R, Warren, R.A.J, Wither, S.G. Deposit date: 1998-02-23 Release date: 1998-10-14 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.84 Å) Cite: Insights into transition state stabilization of the beta-1,4-glycosidase Cex by covalent intermediate accumulation in active site mutants. Nat.Struct.Biol., 5, 1998
8RZB	IL-1beta in complex with covalent DEL hit Descriptor: 8-[4-methyl-3-(trifluoromethyl)phenyl]-2-[[(7S)-7-(2-morpholin-4-ylethylcarbamoyl)-4-(phenylsulfonyl)-1,4-diazepan-1-yl]carbonyl]imidazo[1,2-a]pyridine-6-carboxylic acid, Interleukin-1 beta Authors: Rondeau, J.-M, Lehmann, S. Deposit date: 2024-02-12 Release date: 2024-05-22 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.836 Å) Cite: Ligandability Assessment of IL-1 beta by Integrated Hit Identification Approaches. J.Med.Chem., 67, 2024
1GRR	CHLORAMPHENICOL PHOSPHOTRANSFERASE IN COMPLEX WITH 2-Nac-CHLORAMPHENICOL FROM STREPTOMYCES VENEZUELAE Descriptor: CHLORAMPHENICOL 3-O PHOSPHOTRANSFERASE, N-ACETYL-P-NITROPHENYLSERINOL, SULFATE ION Authors: Izard, T. Deposit date: 2001-12-15 Release date: 2002-01-04 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Structural Basis for Chloramphenicol Tolerance in Streptomyces Venezuelae by Chloramphenicol Phosphotransferase Activity Protein Sci., 10, 2001
1CB7	GLUTAMATE MUTASE FROM CLOSTRIDIUM COCHLEARIUM RECONSTITUTED WITH METHYL-COBALAMIN Descriptor: CO-METHYLCOBALAMIN, D(-)-TARTARIC ACID, PROTEIN (GLUTAMATE MUTASE) Authors: Gruber, K, Reitzer, R, Kratky, C. Deposit date: 1999-03-03 Release date: 2000-02-28 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2 Å) Cite: Glutamate mutase from Clostridium cochlearium: the structure of a coenzyme B12-dependent enzyme provides new mechanistic insights. Structure Fold.Des., 7, 1999
1CCN	DIRECT NOE REFINEMENT OF CRAMBIN FROM 2D NMR DATA USING A SLOW-COOLING ANNEALING PROTOCOL Descriptor: CRAMBIN Authors: Bonvin, A.M.J.J, Rullmann, J.A.C, Lamerichs, R.M.J.N, Boelens, R, Kaptein, R. Deposit date: 1993-04-14 Release date: 1993-10-31 Last modified: 2017-11-29 Method: SOLUTION NMR Cite: Direct NOE refinement of biomolecular structures using 2D NMR data J.Biomol.NMR, 1, 1991
5KKN	Crystal structure of human ACC2 BC domain in complex with ND-646, the primary amide of ND-630 Descriptor: 2-[1-[(2~{R})-2-(2-methoxyphenyl)-2-(oxan-4-yloxy)ethyl]-5-methyl-6-(1,3-oxazol-2-yl)-2,4-bis(oxidanylidene)thieno[2,3-d]pyrimidin-3-yl]-2-methyl-propanamide, Acetyl-CoA carboxylase 2 Authors: Wang, R, Paul, D, Tong, L. Deposit date: 2016-06-22 Release date: 2016-07-13 Last modified: 2024-03-06 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Acetyl-CoA carboxylase inhibition by ND-630 reduces hepatic steatosis, improves insulin sensitivity, and modulates dyslipidemia in rats. Proc.Natl.Acad.Sci.USA, 113, 2016
1CCW	STRUCTURE OF THE COENZYME B12 DEPENDENT ENZYME GLUTAMATE MUTASE FROM CLOSTRIDIUM COCHLEARIUM Descriptor: CYANOCOBALAMIN, D(-)-TARTARIC ACID, PROTEIN (GLUTAMATE MUTASE) Authors: Reitzer, R, Gruber, K, Kratky, C. Deposit date: 1999-03-01 Release date: 2000-03-01 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Glutamate mutase from Clostridium cochlearium: the structure of a coenzyme B12-dependent enzyme provides new mechanistic insights Structure Fold.Des., 7, 1999
1GZB	PEROXIDASE Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, PEROXIDASE, ... Authors: Fukuyama, K, Kunishima, N, Amada, F. Deposit date: 1996-11-13 Release date: 1997-03-12 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Pentacoordination of the heme iron of Arthromyces ramosus peroxidase shown by a 1.8 A resolution crystallographic study at pH 4.5. FEBS Lett., 378, 1996
1H1D	Catechol O-Methyltransferase Descriptor: 1-(3,4,DIHYDROXY-5-NITROPHENYL)-3-{4-[3-(TRIFLUOROMETHYL) PHENYL] PIPERAZIN-1-YL}PROPAN-1-ONE, CATECHOL-O-METHYLTRANSFERASE, MAGNESIUM ION, ... Authors: Archer, M, Rodrigues, M.L, Matias, P.M, Bonifacio, M.J, Learmonth, D.A, Soares-da-Silva, P, Carrondo, M.A. Deposit date: 2002-07-12 Release date: 2003-07-17 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2 Å) Cite: Kinetics and Crystal Structure of Catechol-O-Methyltransferase Complex with Co-Substrate and a Novel Inhibitor with Potential Therapeutic Application Mol.Pharmacol., 62, 2002
1CC4	PHE161 AND ARG166 VARIANTS OF P-HYDROXYBENZOATE HYDROXYLASE. IMPLICATIONS FOR NADPH RECOGNITION AND STRUCTURAL STABILITY. Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, P-HYDROXYBENZOIC ACID, PROTEIN (P-HYDROXYBENZOATE HYDROXYLASE) Authors: Eppink, M.H.M, Bunthof, C, Schreuder, H.A, Van Berkel, W.J.H. Deposit date: 1999-03-04 Release date: 1999-03-12 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Phe161 and Arg166 variants of p-hydroxybenzoate hydroxylase. Implications for NADPH recognition and structural stability. Febs Lett., 443, 1999
1CCM	DIRECT NOE REFINEMENT OF CRAMBIN FROM 2D NMR DATA USING A SLOW-COOLING ANNEALING PROTOCOL Descriptor: CRAMBIN Authors: Bonvin, A.M.J.J, Rullmann, J.A.C, Lamerichs, R.M.J.N, Boelens, R, Kaptein, R. Deposit date: 1993-04-14 Release date: 1993-10-31 Last modified: 2017-11-29 Method: SOLUTION NMR Cite: "Ensemble" iterative relaxation matrix approach: a new NMR refinement protocol applied to the solution structure of crambin. Proteins, 15, 1993
1GOH	NOVEL THIOETHER BOND REVEALED BY A 1.7 ANGSTROMS CRYSTAL STRUCTURE OF GALACTOSE OXIDASE Descriptor: GALACTOSE OXIDASE, SODIUM ION Authors: Ito, N, Phillips, S.E.V, Knowles, P.F. Deposit date: 1993-09-30 Release date: 1994-01-31 Last modified: 2023-07-26 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Novel thioether bond revealed by a 1.7 A crystal structure of galactose oxidase. Nature, 350, 1991
2HIU	NMR STRUCTURE OF HUMAN INSULIN IN 20% ACETIC ACID, ZINC-FREE, 10 STRUCTURES Descriptor: INSULIN Authors: Hua, Q.X, Gozani, S.N, Chance, R.E, Hoffmann, J.A, Frank, B.H, Weiss, M.A. Deposit date: 1996-10-08 Release date: 1997-04-01 Last modified: 2017-11-29 Method: SOLUTION NMR Cite: Structure of a protein in a kinetic trap. Nat.Struct.Biol., 2, 1995
1CCD	REFINED STRUCTURE OF RAT CLARA CELL 17 KDA PROTEIN AT 3.0 ANGSTROMS RESOLUTION Descriptor: CLARA CELL 17 kD PROTEIN, SULFATE ION Authors: Umland, T.C, Swaminathan, S, Furey, W, Singh, G, Pletcher, J, Sax, M. Deposit date: 1991-09-17 Release date: 1994-01-31 Last modified: 2017-11-29 Method: X-RAY DIFFRACTION (3 Å) Cite: Refined structure of rat Clara cell 17 kDa protein at 3.0 A resolution. J.Mol.Biol., 224, 1992
1KGQ	Crystal Structure of Tetrahydrodipicolinate N-Succinyltransferase in Complex with L-2-aminopimelate and Succinamide-CoA Descriptor: (2S)-2-aminoheptanedioic acid, 2,3,4,5-TETRAHYDROPYRIDINE-2-CARBOXYLATE N-SUCCINYLTRANSFERASE, SUCCINAMIDE-COA Authors: Beaman, T.W, Vogel, K.W, Drueckhammer, D.G, Blanchard, J.S, Roderick, S.L. Deposit date: 2001-11-28 Release date: 2002-04-03 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2 Å) Cite: Acyl group specificity at the active site of tetrahydridipicolinate N-succinyltransferase. Protein Sci., 11, 2002
1C5G	PLASMINOGEN ACTIVATOR INHIBITOR-1 Descriptor: PLASMINOGEN ACTIVATOR INHIBITOR-1 Authors: Goldsmith, E.J. Deposit date: 1999-12-07 Release date: 1999-12-17 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Engineering of plasminogen activator inhibitor-1 to reduce the rate of latency transition. Nat.Struct.Biol., 2, 1995
2C93	thrombin inhibitors Descriptor: DIMETHYL SULFOXIDE, HIRUDIN VARIANT-2, N-[(2R,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-4-METHOXY-2,3,6-TRIMETHYLBENZENESULFONAMIDE, ... Authors: Howard, N, Abell, C, Blakemore, W, Carr, R, Chessari, G, Congreve, M, Howard, S, Jhoti, H, Murray, C.W, Seavers, L.C.A, van Montfort, R.L.M. Deposit date: 2005-12-09 Release date: 2006-07-04 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Application of Fragment Screening and Fragment Linking to the Discovery of Novel Thrombin Inhibitors J.Med.Chem., 49, 2006
2Y0E	BceC and the final step of UGDs reaction Descriptor: ACETATE ION, GLYCEROL, SULFATE ION, ... Authors: Rocha, J, Popescu, A.O, Borges, P, Mil-Homens, D, Sa-Correia, I, Fialho, A.M, Frazao, C. Deposit date: 2010-12-02 Release date: 2011-07-27 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Structure of Burkholderia Cepacia Udp-Glucose Dehydrogenase (Ugd) Bcec and Role of Tyr10 in Final Hydrolysis of Ugd Thioester Intermediate. J.Bacteriol., 193, 2011
3FTX	Leukotriene A4 hydrolase in complex with dihydroresveratrol and bestatin Descriptor: 2-(3-AMINO-2-HYDROXY-4-PHENYL-BUTYRYLAMINO)-4-METHYL-PENTANOIC ACID, 5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol, ACETATE ION, ... Authors: Davies, D.R. Deposit date: 2009-01-13 Release date: 2009-07-28 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.96 Å) Cite: Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. J.Med.Chem., 52, 2009
3FUI	Leukotriene A4 hydrolase in complex with N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline Descriptor: IMIDAZOLE, Leukotriene A-4 hydrolase, N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline, ... Authors: Davies, D.R. Deposit date: 2009-01-14 Release date: 2009-07-28 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. J.Med.Chem., 52, 2009
2C8Z	thrombin inhibitors Descriptor: 1-(3-CHLOROPHENYL)METHANAMINE, DIMETHYL SULFOXIDE, HIRUDIN VARIANT-2, ... Authors: Howard, N, Abell, C, Blakemore, W, Carr, R, Chessari, G, Congreve, M, Howard, S, Jhoti, H, Murray, C.W, Seavers, L.C.A, van Montfort, R.L.M. Deposit date: 2005-12-08 Release date: 2006-07-04 Last modified: 2023-12-13 Method: X-RAY DIFFRACTION (2.14 Å) Cite: Application of Fragment Screening and Fragment Linking to the Discovery of Novel Thrombin Inhibitors J.Med.Chem., 49, 2006
3FU0	Leukotriene A4 hydrolase in complex with fragment 4-(4-fluorobenzoyl)pyridine Descriptor: (4-fluorophenyl)(pyridin-4-yl)methanone, ACETATE ION, IMIDAZOLE, ... Authors: Davies, D.R. Deposit date: 2009-01-13 Release date: 2009-07-28 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. J.Med.Chem., 52, 2009
3FUH	Leukotriene A4 hydrolase in complex with fragment 5-hydroxyindole and bestatin Descriptor: 1H-indol-5-ol, 2-(3-AMINO-2-HYDROXY-4-PHENYL-BUTYRYLAMINO)-4-METHYL-PENTANOIC ACID, IMIDAZOLE, ... Authors: Davies, D.R. Deposit date: 2009-01-14 Release date: 2009-07-28 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. J.Med.Chem., 52, 2009

<873874875876877878879880881882883884885886887888>