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The first ketoreductase of the tylosin PKS
Descriptor:	Tylactone synthase starter module and modules 1 & 2
Authors:	Keatinge-Clay, A.T, Stroud, R.M.
Deposit date:	2007-07-14
Release date:	2007-08-28
Last modified:	2023-11-01
Method:	X-RAY DIFFRACTION (1.95 Å)
Cite:	A tylosin ketoreductase reveals how chirality is determined in polyketides Chem.Biol., 14, 2007

1GBT

STRUCTURE OF AN ACYL-ENZYME INTERMEDIATE DURING CATALYSIS: (GUANIDINOBENZOYL) TRYPSIN
Descriptor:	4-carbamimidamidobenzoic acid, BETA-TRYPSIN, CALCIUM ION, ...
Authors:	Singer, P.T, Sweet, R.M.
Deposit date:	1991-09-17
Release date:	1994-01-31
Last modified:	2024-06-19
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Structure of an acyl-enzyme intermediate during catalysis: (guanidinobenzoyl)trypsin. Biochemistry, 29, 1990

4ZDZ

Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140F mutant complexed with fluconazole
Descriptor:	2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Sagatova, A, Keniya, M.V, Wilson, R.K, Tyndall, J.D.A, Monk, B.C.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

4ZE0

Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140F mutant complexed with Voriconazole
Descriptor:	Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE, Voriconazole
Authors:	Sagatova, A, Keniya, M.V, Wilson, R, Tyndall, J.D.A, Monk, B.C.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

4ZDY

Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140F mutant complexed with itraconazole
Descriptor:	2-[(2R)-butan-2-yl]-4-{4-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Sagatova, A, Keniya, M.V, Wilson, R.K, Tyndall, J.D.A, Monk, B.C.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.02 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

4ZE3

Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140H mutant complexed with fluconazole
Descriptor:	2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Sagatova, A, Keniya, M.V, Wilson, R, Monk, B.C, Tyndall, J.D.A.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.2 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

4ZE1

Saccharomyces cerevisiae CYP51 Y140F mutant complexed with posaconazole in the active site
Descriptor:	Lanosterol 14-alpha demethylase, POSACONAZOLE, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Sagatova, A, Keniya, M.V, Wilson, R, Tyndall, J.D.A, Monk, B.C.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2024-03-13
Method:	X-RAY DIFFRACTION (2.05 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

4ZE2

Saccharomyces cerevisiae CYP51 (Lanosterol 14-alpha demethylase) Y140H mutant complexed with itraconazole
Descriptor:	2-[(2R)-butan-2-yl]-4-{4-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Sagatova, A, Keniya, M.V, Wilson, R, Monk, B.C, Tyndall, J.D.A.
Deposit date:	2015-04-20
Release date:	2016-03-30
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Triazole resistance mediated by mutations of a conserved active site tyrosine in fungal lanosterol 14 alpha-demethylase. Sci Rep, 6, 2016

1TYS

WATER-MEDIATED SUBSTRATE(SLASH)PRODUCT DISCRIMINATION: THE PRODUCT COMPLEX OF THYMIDYLATE SYNTHASE AT 1.83 ANGSTROMS
Descriptor:	DIHYDROFOLIC ACID, THYMIDINE-5'-PHOSPHATE, THYMIDYLATE SYNTHASE
Authors:	Fauman, E, Rutenber, E, Stroud, R.
Deposit date:	1993-05-07
Release date:	1994-06-22
Last modified:	2024-06-05
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Water-mediated substrate/product discrimination: the product complex of thymidylate synthase at 1.83 A. Biochemistry, 33, 1994

5V5Z

Structure of CYP51 from the pathogen Candida albicans
Descriptor:	2-[(2R)-butan-2-yl]-4-{4-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:	Keniya, M.V, Sabherwal, M, Wilson, R.K, Sagatova, A.A, Tyndall, J.D.A, Monk, B.C.
Deposit date:	2017-03-15
Release date:	2017-03-29
Last modified:	2023-10-04
Method:	X-RAY DIFFRACTION (2.9 Å)
Cite:	Crystal Structures of Full-Length Lanosterol 14 alpha-Demethylases of Prominent Fungal Pathogens Candida albicans and Candida glabrata Provide Tools for Antifungal Discovery. Antimicrob.Agents Chemother., 62, 2018

2PQU

Crystal structure of KH1 domain of human PCBP2 complexed to single-stranded 12-mer telomeric dna
Descriptor:	12-mer C-rich strand of human telomeric DNA, Poly(rC)-binding protein 2
Authors:	James, T.L, Lee, J.
Deposit date:	2007-05-02
Release date:	2007-06-12
Last modified:	2019-07-24
Method:	X-RAY DIFFRACTION (2.12 Å)
Cite:	X-ray crystallographic and NMR studies of protein-protein and protein-nucleic acid interactions involving the KH domains from human poly(C)-binding protein-2. Rna, 13, 2007

2PY9

Protein-RNA Interaction involving KH1 domain from Human Poly(C)-Binding Protein-2
Descriptor:	12-mer C-rich strand of human telomeric RNA, Poly(rC)-binding protein 2
Authors:	James, T.L, Du, Z, Lee, J.K.
Deposit date:	2007-05-15
Release date:	2007-06-12
Last modified:	2011-07-13
Method:	X-RAY DIFFRACTION (2.56 Å)
Cite:	X-ray crystallographic and NMR studies of protein-protein and protein-nucleic acid interactions involving the KH domains from human poly(C)-binding protein-2. Rna, 13, 2007

1EER

CRYSTAL STRUCTURE OF HUMAN ERYTHROPOIETIN COMPLEXED TO ITS RECEPTOR AT 1.9 ANGSTROMS
Descriptor:	ERYTHROPOIETIN, ERYTHROPOIETIN RECEPTOR
Authors:	Syed, R.S, Li, C.
Deposit date:	1998-07-24
Release date:	1999-10-01
Last modified:	2021-11-03
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	Efficiency of signalling through cytokine receptors depends critically on receptor orientation. Nature, 395, 1998

4KPW

Crystal structure of His-tagged human thymidylate synthase R175A mutant
Descriptor:	1,2-ETHANEDIOL, SULFATE ION, Thymidylate synthase
Authors:	Pozzi, C, Mangani, S.
Deposit date:	2013-05-14
Release date:	2014-05-14
Last modified:	2023-09-20
Method:	X-RAY DIFFRACTION (2.03 Å)
Cite:	Hotspots in an obligate homodimeric anticancer target. Structural and functional effects of interfacial mutations in human thymidylate synthase. J.Med.Chem., 58, 2015

4O1X

Crystal structure of human thymidylate synthase double mutant C195S-Y202C
Descriptor:	1,2-ETHANEDIOL, CHLORIDE ION, SULFATE ION, ...
Authors:	Pozzi, C, Mangani, S.
Deposit date:	2013-12-16
Release date:	2015-01-21
Last modified:	2023-03-01
Method:	X-RAY DIFFRACTION (2.32 Å)
Cite:	Destabilizers of the thymidylate synthase homodimer accelerate its proteasomal degradation and inhibit cancer growth. Elife, 11, 2022

2B6P

X-ray structure of lens Aquaporin-0 (AQP0) (lens MIP) in an open pore state
Descriptor:	Lens fiber major intrinsic protein
Authors:	Gonen, T, Cheng, Y, Sliz, P, Hiroaki, Y, Fujiyoshi, Y, Harrison, S.C, Walz, T.
Deposit date:	2005-10-03
Release date:	2005-12-06
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (2.4 Å)
Cite:	Lipid-protein interactions in double-layered two-dimensional AQP0 crystals. Nature, 438, 2005

1AJM

CRYSTAL STRUCTURE OF THYMIDYLATE SYNTHASE R126E MUTANT
Descriptor:	THYMIDYLATE SYNTHASE
Authors:	Strop, P, Montfort, W.R.
Deposit date:	1997-05-06
Release date:	1997-11-12
Last modified:	2021-11-03
Method:	X-RAY DIFFRACTION (2.4 Å)
Cite:	Crystal structures of a marginally active thymidylate synthase mutant, Arg 126-->Glu. Protein Sci., 6, 1997

1LS1

T. aquaticus Ffh NG Domain at 1.1A Resolution
Descriptor:	MAGNESIUM ION, OXYGEN MOLECULE, SIGNAL RECOGNITION PARTICLE PROTEIN
Authors:	Ramirez, U.D, Minasov, G, Freymann, D.M.
Deposit date:	2002-05-16
Release date:	2002-11-16
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (1.1 Å)
Cite:	Structural Basis for Mobility in the 1.1 A Crystal Structure of the NG Domain of Thermus aquaticus Ffh J.Mol.Biol., 320, 2002

7KDT

Human Tom70 in complex with SARS CoV2 Orf9b
Descriptor:	Mitochondrial import receptor subunit TOM70, ORF9b protein
Authors:	QCRG Structural Biology Consortium
Deposit date:	2020-10-09
Release date:	2020-10-21
Last modified:	2024-03-06
Method:	ELECTRON MICROSCOPY (3.05 Å)
Cite:	Comparative host-coronavirus protein interaction networks reveal pan-viral disease mechanisms. Science, 370, 2020

1TRM

THE THREE-DIMENSIONAL STRUCTURE OF ASN102 MUTANT OF TRYPSIN. ROLE OF ASP102 IN SERINE PROTEASE CATALYSIS
Descriptor:	BENZAMIDINE, CALCIUM ION, TRYPSIN
Authors:	Sprang, S, Standing, T, Fletterick, R.J.
Deposit date:	1987-10-21
Release date:	1988-07-16
Last modified:	2017-11-29
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	The three-dimensional structure of Asn102 mutant of trypsin: role of Asp102 in serine protease catalysis. Science, 237, 1987

1C1T

RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
Descriptor:	BIS(5-AMIDINO-BENZIMIDAZOLYL)METHANE, CALCIUM ION, MAGNESIUM ION, ...
Authors:	Katz, B.A, Luong, C.
Deposit date:	1999-07-21
Release date:	2000-07-26
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.37 Å)
Cite:	Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998

1C2L

RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
Descriptor:	CALCIUM ION, CHLORIDE ION, TRYPSIN, ...
Authors:	Katz, B.A, Luong, C.
Deposit date:	1999-07-21
Release date:	2000-07-26
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.5 Å)
Cite:	Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998

1C2I

RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
Descriptor:	BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANE KETONE, CALCIUM ION, CHLORIDE ION, ...
Authors:	Katz, B.A, Luong, C.
Deposit date:	1999-07-21
Release date:	2000-07-26
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.47 Å)
Cite:	Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998

1C1Q

RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
Descriptor:	(5-AMIDINO-2-BENZIMIDAZOLYL)(2-BENZIMIDAZOLYL)METHANE, CALCIUM ION, MAGNESIUM ION, ...
Authors:	Katz, B.A, Luong, C.
Deposit date:	1999-07-21
Release date:	2000-07-26
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.37 Å)
Cite:	Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998

1C2D

RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES
Descriptor:	BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANE KETONE, CALCIUM ION, MAGNESIUM ION, ...
Authors:	Katz, B.A, Luong, C.
Deposit date:	1999-07-21
Release date:	2000-07-26
Last modified:	2023-12-27
Method:	X-RAY DIFFRACTION (1.65 Å)
Cite:	Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998

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