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3SL5
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BU of 3sl5 by Molmil
Crystal structure of the catalytic domain of PDE4D2 complexed with compound 10d
Descriptor: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, DIMETHYL SULFOXIDE, ...
Authors:Feil, S.F.
Deposit date:2011-06-24
Release date:2011-10-26
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Thiophene inhibitors of PDE4: Crystal structures show a second binding mode at the catalytic domain of PDE4D2.
Bioorg.Med.Chem.Lett., 21, 2011
3SOY
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BU of 3soy by Molmil
Nuclear transport factor 2 (NTF2-like) superfamily protein from Salmonella enterica subsp. enterica serovar Typhimurium str. LT2
Descriptor: GLYCEROL, IMIDAZOLE, MALONATE ION, ...
Authors:Cuff, M.E, Li, H, Jedrzejczak, R, Brown, R.N, Adkins, J.N, Joachimiak, A, Midwest Center for Structural Genomics (MCSG), Program for the Characterization of Secreted Effector Proteins (PCSEP)
Deposit date:2011-06-30
Release date:2011-08-10
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Nuclear transport factor 2 (NTF2-like) superfamily protein from Salmonella enterica subsp. enterica serovar Typhimurium str. LT2
TO BE PUBLISHED
3T15
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BU of 3t15 by Molmil
Structure of green-type Rubisco activase from tobacco
Descriptor: Ribulose bisphosphate carboxylase/oxygenase activase 1, chloroplastic
Authors:Stotz, M, Wendler, P, Mueller-Cajar, O, Hartl, F.U, Bracher, A, Hayer-Hartl, M.
Deposit date:2011-07-21
Release date:2011-11-09
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Structure of green-type Rubisco activase from tobacco.
Nat.Struct.Mol.Biol., 18, 2011
3T4U
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BU of 3t4u by Molmil
L29I Mutation in an Aryl Esterase from Pseudomonas fluorescens Leads to Unique Peptide Flip and Increased Activity
Descriptor: Arylesterase, CHLORIDE ION, GLYCEROL, ...
Authors:Kazlauskas, R.J, Yin, T, Purpero, V.M.
Deposit date:2011-07-26
Release date:2012-08-01
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:L29I Mutation in an Aryl Esterase from Pseudomonas fluorescens Leads to Unique Peptide Flip and Increased Activity
To be Published
3SYK
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BU of 3syk by Molmil
Crystal structure of the AAA+ protein CbbX, selenomethionine structure
Descriptor: Protein CbbX, SULFATE ION
Authors:Mueller-Cajar, O, Stotz, M, Wendler, P, Hartl, F.U, Bracher, A, Hayer-Hartl, M.
Deposit date:2011-07-18
Release date:2011-11-09
Last modified:2019-11-20
Method:X-RAY DIFFRACTION (3.08 Å)
Cite:Structure and function of the AAA+ protein CbbX, a red-type Rubisco activase.
Nature, 479, 2011
3T0T
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BU of 3t0t by Molmil
Crystal structure of S. aureus Pyruvate Kinase
Descriptor: N'-[(1E)-1-(1H-benzimidazol-2-yl)ethylidene]-5-bromo-2-hydroxybenzohydrazide, PHOSPHATE ION, Pyruvate kinase
Authors:Worrall, L.J, Vuckovic, M, Strynadka, N.C.J.
Deposit date:2011-07-20
Release date:2012-06-06
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Cheminformatics-driven discovery of selective, nanomolar inhibitors for staphylococcal pyruvate kinase.
Acs Chem.Biol., 7, 2012
4XUU
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BU of 4xuu by Molmil
The hSac2 domain from human phosphoinositide phosphatase Sac2
Descriptor: Phosphatidylinositide phosphatase SAC2
Authors:Hsu, F, Mao, Y.
Deposit date:2015-01-26
Release date:2015-02-25
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.62 Å)
Cite:Structure of the hSac2 domain at 2.62
To Be Published
3SOT
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BU of 3sot by Molmil
Crystal structure of a Multidomain protein including DUF1735 (BACOVA_03322) from Bacteroides ovatus at 2.80 A resolution
Descriptor: 1,2-ETHANEDIOL, Multidomain protein including DUF1735
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2011-06-30
Release date:2011-07-27
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Crystal structure of a Multidomain protein including DUF1735 (BACOVA_03322) from Bacteroides ovatus at 2.80 A resolution
To be published
3UMP
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BU of 3ump by Molmil
Crystal structure of the Phosphofructokinase-2 from Escherichia coli in complex with Cesium and ATP
Descriptor: 6-phosphofructokinase isozyme 2, ADENOSINE-5'-TRIPHOSPHATE, CESIUM ION, ...
Authors:Pereira, H.M, Caniuguir, A, Baez, M, Cabrera, R, Garratt, R.C, Babul, J.
Deposit date:2011-11-14
Release date:2012-11-14
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.849 Å)
Cite:A Ribokinase Family Conserved Monovalent Cation Binding Site Enhances the MgATP-induced Inhibition in E. coli Phosphofructokinase-2
Biophys.J., 105, 2013
3UM7
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BU of 3um7 by Molmil
Crystal structure of the human two pore domain K+ ion channel TRAAK (K2P4.1)
Descriptor: POTASSIUM ION, Potassium channel subfamily K member 4
Authors:Brohawn, S.G, MacKinnon, R.
Deposit date:2011-11-12
Release date:2012-02-08
Method:X-RAY DIFFRACTION (3.31 Å)
Cite:Crystal structure of the human K2P TRAAK, a lipid- and mechano-sensitive K+ ion channel.
Science, 335, 2012
3SRS
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BU of 3srs by Molmil
S. aureus Dihydrofolate Reductase complexed with novel 7-aryl-2,4-diaminoquinazolines
Descriptor: 7-(5-bromo-2-ethoxyphenyl)-6-methylquinazoline-2,4-diamine, Dihydrofolate reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Hilgers, M.
Deposit date:2011-07-07
Release date:2011-08-31
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structure-based design of new DHFR-based antibacterial agents: 7-aryl-2,4-diaminoquinazolines.
Bioorg.Med.Chem.Lett., 21, 2011
3S5T
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BU of 3s5t by Molmil
Crystal structure of a member of duf3298 family (BF2082) from bacteroides fragilis nctc 9343 at 2.30 A resolution
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, CHLORIDE ION, DUF3298 family protein, ...
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2011-05-23
Release date:2011-06-29
Last modified:2023-02-01
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a Member of DUF3298 family (BF2082) from Bacteroides fragilis NCTC 9343 at 2.30 A resolution
To be published
3S3B
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BU of 3s3b by Molmil
Structure of Thermus thermophilus cytochrome ba3 oxidase 240s after Xe depressurization
Descriptor: COPPER (II) ION, Cytochrome c oxidase polypeptide 2A, Cytochrome c oxidase subunit 1, ...
Authors:Luna, V.M, Fee, J.A, Deniz, A.A, Stout, C.D.
Deposit date:2011-05-18
Release date:2012-05-23
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Mobility of Xe atoms within the oxygen diffusion channel of cytochrome ba(3) oxidase.
Biochemistry, 51, 2012
3S39
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BU of 3s39 by Molmil
Structure of Thermus thermophilus cytochrome ba3 oxidase 60s after Xe depressurization
Descriptor: COPPER (II) ION, Cytochrome c oxidase polypeptide 2A, Cytochrome c oxidase subunit 1, ...
Authors:Luna, V.M, Fee, J.A, Deniz, A.A, Stout, C.D.
Deposit date:2011-05-17
Release date:2012-05-23
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (4.8 Å)
Cite:Mobility of Xe atoms within the oxygen diffusion channel of cytochrome ba(3) oxidase.
Biochemistry, 51, 2012
3S9J
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BU of 3s9j by Molmil
Crystal structure of a member of duf4221 family (BVU_1028) from Bacteroides vulgatus atcc 8482 at 1.75 A resolution
Descriptor: FORMIC ACID, GLYCEROL, Member of DUF4221 family, ...
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2011-06-01
Release date:2011-06-22
Last modified:2023-02-01
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Crystal structure of a Member of DUF4221 family (BVU_1028) from Bacteroides vulgatus ATCC 8482 at 1.75 A resolution
To be published
3SD3
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BU of 3sd3 by Molmil
The structure of the tetrahydrofolate riboswitch containing a U25C mutation
Descriptor: IRIDIUM HEXAMMINE ION, N-[4-({[(6S)-2-amino-5-formyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid, Tetrahydrofolate riboswitch
Authors:Reyes, F.E, Trausch, J.J, Ceres, P, Batey, R.T.
Deposit date:2011-06-08
Release date:2011-09-21
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:The structure of a tetrahydrofolate-sensing riboswitch reveals two ligand binding sites in a single aptamer.
Structure, 19, 2011
3SWF
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BU of 3swf by Molmil
CNGA1 621-690 containing CLZ domain
Descriptor: ZINC ION, cGMP-gated cation channel alpha-1
Authors:Shuart, N.G, Haitin, Y, Camp, S.S, Black, K.D, Zagotta, W.N.
Deposit date:2011-07-13
Release date:2011-09-14
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Molecular mechanism for 3:1 subunit stoichiometry of rod cyclic nucleotide-gated ion channels.
Nat Commun, 2, 2011
3SWJ
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BU of 3swj by Molmil
Crystal structure of Campylobacter jejuni ChuZ
Descriptor: AZIDE ION, PROTOPORPHYRIN IX CONTAINING FE, Putative uncharacterized protein
Authors:Hu, Y.
Deposit date:2011-07-14
Release date:2011-11-09
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.409 Å)
Cite:Crystal structure of Campylobacter jejuni ChuZ: a split-barrel family heme oxygenase with a novel heme-binding mode.
Biochem.Biophys.Res.Commun., 415, 2011
3T07
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BU of 3t07 by Molmil
Crystal structure of S. aureus Pyruvate Kinase in complex with a naturally occurring bis-indole alkaloid
Descriptor: (3S,5R)-3,5-bis(6-bromo-1H-indol-3-yl)piperazin-2-one, PHOSPHATE ION, Pyruvate kinase
Authors:Worrall, L.J, Vuckovic, M, Strynadka, N.C.J.
Deposit date:2011-07-19
Release date:2011-10-26
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Methicillin-resistant Staphylococcus aureus (MRSA) pyruvate kinase as a target for bis-indole alkaloids with antibacterial activities.
J.Biol.Chem., 286, 2011
3T5P
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BU of 3t5p by Molmil
Crystal structure of a putative diacylglycerol kinase from Bacillus anthracis str. Sterne
Descriptor: BmrU protein, MAGNESIUM ION
Authors:Hou, J, Zheng, H, Chruszcz, M, Cooper, D.R, Onopriyenko, O, Grimshaw, S, Savchenko, A, Anderson, W.F, Minor, W, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2011-07-27
Release date:2011-09-07
Last modified:2022-04-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of a putative diacylglycerol kinase from Bacillus anthracis str. Sterne
To be Published
3V6I
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BU of 3v6i by Molmil
Crystal structure of the peripheral stalk of Thermus thermophilus H+-ATPase/synthase at 2.25 A resolution
Descriptor: CALCIUM ION, SODIUM ION, V-type ATP synthase subunit E, ...
Authors:Stewart, A.G, Lee, L.K, Donohoe, M, Chaston, J.J, Stock, D.
Deposit date:2011-12-19
Release date:2012-02-22
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:The dynamic stator stalk of rotary ATPases
Nat Commun, 3, 2012
3VHR
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BU of 3vhr by Molmil
Crystal Structure of capsular polysaccharide assembling protein CapF from Staphylococcus aureus in space group C2221
Descriptor: Capsular polysaccharide synthesis enzyme Cap5F, FORMIC ACID, ZINC ION
Authors:Miyafusa, T, Yoshikazu, T, Caaveiro, J.M.M, Tsumoto, K.
Deposit date:2011-09-01
Release date:2012-02-15
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Crystal structure of the enzyme CapF of Staphylococcus aureus reveals a unique architecture composed of two functional domains.
Biochem.J., 443, 2012
3VOL
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BU of 3vol by Molmil
X-ray Crystal Structure of PAS-HAMP Aer2 in the CN-bound Form
Descriptor: Aerotaxis transducer Aer2, CYANIDE ION, PROTOPORPHYRIN IX CONTAINING FE
Authors:Sawai, H, Sugimoto, H, Shiro, Y, Aono, S.
Deposit date:2012-01-27
Release date:2012-05-23
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.399 Å)
Cite:Structural basis for oxygen sensing and signal transduction of the heme-based sensor protein Aer2 from Pseudomonas aeruginosa
Chem.Commun.(Camb.), 48, 2012
3VHD
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BU of 3vhd by Molmil
Hsp90 alpha N-terminal domain in complex with a macrocyclic inhibitor, CH5164840
Descriptor: 4-amino-18,20-dimethyl-7-thia-3,5,11,15-tetraazatricyclo[15.3.1.1(2,6)]docosa-1(20),2,4,6(22),17(21),18-hexaene-10,16-dione, Heat shock protein HSP 90-alpha
Authors:Fukami, T.A, Ono, N.
Deposit date:2011-08-24
Release date:2012-07-18
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Design and synthesis of novel macrocyclic 2-amino-6-arylpyrimidine Hsp90 inhibitors
Bioorg.Med.Chem.Lett., 22, 2012
3VOT
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Crystal structure of L-amino acid ligase from Bacillus licheniformis
Descriptor: ADENOSINE-5'-DIPHOSPHATE, CALCIUM ION, CHLORIDE ION, ...
Authors:Suzuki, M, Takahashi, Y, Noguchi, A, Arai, T, Yagasaki, M, Kino, K, Saito, J.
Deposit date:2012-02-08
Release date:2012-11-07
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The structure of L-amino-acid ligase from Bacillus licheniformis
Acta Crystallogr.,Sect.D, 68, 2012

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