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3K8Q
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Crystal structure of human purine nucleoside phosphorylase in complex with SerMe-Immucillin H
Descriptor: 7-({[2-hydroxy-1-(hydroxymethyl)ethyl]amino}methyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one, PHOSPHATE ION, Purine nucleoside phosphorylase
Authors:Ho, M, Almo, S.C, Scharmm, V.L.
Deposit date:2009-10-14
Release date:2010-03-02
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of human nucleoside phosphorylase in complex with SerMe-ImmH
Proc.Natl.Acad.Sci.USA, 2010
6ZZQ
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Crystal structure of (R)-3-hydroxybutyrate dehydrogenase from Acinetobacter baumannii complexed with NAD+ and acetoacetate
Descriptor: 3-hydroxybutyrate dehydrogenase, ACETOACETIC ACID, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Machado, T.F.G, da Silva, R.G, Gloster, T.M, McMahon, S.A, Oehler, V.
Deposit date:2020-08-05
Release date:2020-10-07
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Dissecting the Mechanism of ( R )-3-Hydroxybutyrate Dehydrogenase by Kinetic Isotope Effects, Protein Crystallography, and Computational Chemistry.
Acs Catalysis, 10, 2020
6ZT1
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BU of 6zt1 by Molmil
Two states of a de novo hexameric coiled coil assembly CC-Type2-(LaIdGe)4
Descriptor: CC-Type2-(LaIdGe)4
Authors:Rhys, G.G, Brady, R.L, Woolfson, D.N.
Deposit date:2020-07-17
Release date:2021-02-03
Last modified:2025-04-09
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Structural resolution of switchable states of a de novo peptide assembly.
Nat Commun, 12, 2021
3JV7
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BU of 3jv7 by Molmil
Structure of ADH-A from Rhodococcus ruber
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, ACETIC ACID, ADH-A, ...
Authors:Karabec, M, Lyskowski, A, Gruber, K.
Deposit date:2009-09-16
Release date:2010-08-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural insights into substrate specificity and solvent tolerance in alcohol dehydrogenase ADH-'A' from Rhodococcus ruber DSM 44541.
Chem.Commun.(Camb.), 2010
8BZL
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BU of 8bzl by Molmil
Human 20S Proteasome in complex with peptide activator peptide BLM42
Descriptor: 1-ETHYL-PYRROLIDINE-2,5-DIONE, ARG-SER-TYR-TYR-SER, CHLORIDE ION, ...
Authors:Henneberg, F, Chari, A, Jankowska, E, Witkowska, J.
Deposit date:2022-12-15
Release date:2023-12-27
Last modified:2025-02-26
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Blm10-Based Compounds Add to the Knowledge of How Allosteric Modulators Influence Human 20S Proteasome.
Acs Chem.Biol., 2025
3K0D
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BU of 3k0d by Molmil
Crystal Structure of CNG mimicking NaK mutant, NaK-ETPP, K+ complex
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, POTASSIUM ION, Potassium channel protein NaK
Authors:Jiang, Y, Derebe, M.G.
Deposit date:2009-09-24
Release date:2011-01-12
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural studies of ion permeation and Ca2+ blockage of a bacterial channel mimicking the cyclic nucleotide-gated channel pore.
Proc.Natl.Acad.Sci.USA, 108, 2011
8C6R
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BU of 8c6r by Molmil
PBP AccA from A. tumefaciens Bo542 in apoform 4
Descriptor: 1,2-ETHANEDIOL, Agrocinopine utilization periplasmic binding protein AccA, DI(HYDROXYETHYL)ETHER, ...
Authors:Morera, S, Vigouroux, A.
Deposit date:2023-01-12
Release date:2024-01-24
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.884 Å)
Cite:A highly conserved ligand-binding site for AccA transporters of antibiotic and quorum-sensing regulator in Agrobacterium leads to a different specificity.
Biochem.J., 481, 2024
3JTR
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BU of 3jtr by Molmil
Mutations in Cephalosporin Acylase Affecting Stability and Autoproteolysis
Descriptor: GLYCEROL, Glutaryl 7-aminocephalosporanic acid acylase
Authors:Cho, K.J, Kim, J.K, Lee, J.H, Shin, H.J, Park, S.S, Kim, K.H.
Deposit date:2009-09-14
Release date:2010-01-26
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural features of cephalosporin acylase reveal the basis of autocatalytic activation.
Biochem.Biophys.Res.Commun., 390, 2009
3JUY
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Crystal Structure of a 3B3 Variant, a Broadly Neutralizing HIV-1 scFv Antibody
Descriptor: 3B3 single chain variant HIV-1 antibody
Authors:Clark, K.R, Walsh, S.T.
Deposit date:2009-09-15
Release date:2009-12-08
Last modified:2024-11-27
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of a 3B3 variant-A broadly neutralizing HIV-1 scFv antibody.
Protein Sci., 18, 2009
3JUW
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BU of 3juw by Molmil
Putative GnaT-family acetyltransferase from Bordetella pertussis.
Descriptor: Probable GnaT-family acetyltransferase, SULFATE ION
Authors:Osipiuk, J, Wu, R, Cobb, G, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-09-15
Release date:2009-09-22
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:X-ray crystal structure of putative GnaT-family acetyltransferase from Bordetella pertussis.
To be Published
3JV3
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BU of 3jv3 by Molmil
Structure of SH3E-DH unit of murine intersectin-1L
Descriptor: Intersectin-1
Authors:Ahmad, K.F.
Deposit date:2009-09-15
Release date:2010-07-14
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:The minimal autoinhibited unit of the guanine nucleotide exchange factor intersectin.
Plos One, 5, 2010
3JWJ
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BU of 3jwj by Molmil
Crystal structure analysis of the methyltransferase domain of bacterial-AvHen1-CN
Descriptor: Hen1
Authors:Huang, R.H, Chan, C.M, Zhou, C, Brunzelle, J.S.
Deposit date:2009-09-18
Release date:2009-10-20
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural and biochemical insights into 2'-O-methylation at the 3'-terminal nucleotide of RNA by Hen1.
Proc.Natl.Acad.Sci.USA, 106, 2009
7A15
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BU of 7a15 by Molmil
CRYSTAL STRUCTURE OF HUMAN METHIONINE AMINOPEPTIDASE-2 IN COMPLEX WITH AN INHIBITOR GSK2224863A (COMPOUND 42)
Descriptor: 5-chloranyl-6-fluoranyl-3-(4-piperazin-1-yl-2-propan-2-yloxy-phenyl)-1~{H}-indole-2-carboxamide, MANGANESE (II) ION, Methionine aminopeptidase 2, ...
Authors:Thorpe, J.H.
Deposit date:2020-08-11
Release date:2020-09-23
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structure-based optimisation of orally active & reversible MetAP-2 inhibitors maintaining a tight 'molecular budget'.
Bioorg.Med.Chem.Lett., 30, 2020
3JY9
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BU of 3jy9 by Molmil
Janus Kinase 2 Inhibitors
Descriptor: (3S)-3-(4-hydroxyphenyl)-1,5-dihydro-1,5,12-triazabenzo[4,5]cycloocta[1,2,3-cd]inden-4(3H)-one, SODIUM ION, Tyrosine-protein kinase JAK2
Authors:Zuccola, H.J, Ledeboer, M.W, Pierce, A.C.
Deposit date:2009-09-21
Release date:2009-12-01
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Janus kinase 2 inhibitors. Synthesis and characterization of a novel polycyclic azaindole.
J.Med.Chem., 52, 2009
3JXB
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BU of 3jxb by Molmil
Crystal structure of the P22 c2 repressor protein in complex with synthetic operator 9C
Descriptor: 5'-D(*CP*AP*TP*TP*TP*AP*AP*GP*AP*CP*GP*TP*CP*TP*TP*AP*AP*AP*TP*A)-3', 5'-D(*TP*AP*TP*TP*TP*AP*AP*GP*AP*CP*GP*TP*CP*TP*TP*AP*AP*AP*TP*G)-3', Repressor protein C2
Authors:Watkins, D, Koudelka, G.B, Williams, L.D.
Deposit date:2009-09-18
Release date:2010-01-19
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Sequence Recognition of DNA by Protein-Induced Conformational Transitions
J.Mol.Biol., 396, 2010
7A79
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BU of 7a79 by Molmil
Crystal structure of RXR gamma LBD in complexes with palmitic acid and GRIP-1 peptide
Descriptor: Nuclear receptor coactivator 2, PALMITIC ACID, Retinoic acid receptor RXR-gamma
Authors:Chaikuad, A, Merk, D, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2020-08-27
Release date:2020-10-21
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Comprehensive Set of Tertiary Complex Structures and Palmitic Acid Binding Provide Molecular Insights into Ligand Design for RXR Isoforms.
Int J Mol Sci, 21, 2020
3JXJ
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BU of 3jxj by Molmil
Crystal structure of the chicken TRPV4 ankyrin repeat domain
Descriptor: PHOSPHATE ION, Vanilloid receptor-related osmotically activated channel protein
Authors:Phelps, C.B, Choo, S.S, Gaudet, R.
Deposit date:2009-09-19
Release date:2009-12-22
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Mutations in TRPV4 cause Charcot-Marie-Tooth disease type 2C.
Nat.Genet., 42, 2010
7ABP
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BU of 7abp by Molmil
SUGAR-BINDING AND CRYSTALLOGRAPHIC STUDIES OF AN ARABINOSE-BINDING PROTEIN MUTANT (MET108LEU) WHICH EXHIBITS ENHANCED AFFINITY AND ALTERED SPECIFICITY
Descriptor: L-ARABINOSE-BINDING PROTEIN, alpha-D-fucopyranose, beta-D-fucopyranose
Authors:Vermersch, P.S, Tesmer, J.J.G, Quiocho, F.A.
Deposit date:1991-04-25
Release date:1991-10-15
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Sugar-binding and crystallographic studies of an arabinose-binding protein mutant (Met108Leu) that exhibits enhanced affinity and altered specificity.
Biochemistry, 30, 1991
3K29
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BU of 3k29 by Molmil
Structure of a putative YscO homolog CT670 from Chlamydia trachomatis
Descriptor: Putative uncharacterized protein
Authors:Lam, R, Singer, A, Skarina, T, Onopriyenko, O, Bochkarev, A, Brunzelle, J.S, Edwards, A.M, Anderson, W.F, Chirgadze, N.Y, Savchenko, A, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2009-09-29
Release date:2009-10-13
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure and protein-protein interaction studies on Chlamydia trachomatis protein CT670 (YscO Homolog).
J.Bacteriol., 192, 2010
6ZPE
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BU of 6zpe by Molmil
Nonstructural protein 10 (nsp10) from SARS CoV-2
Descriptor: CHLORIDE ION, GLYCEROL, Replicase polyprotein 1ab, ...
Authors:Fisher, S.Z, Kozielski, F.
Deposit date:2020-07-08
Release date:2020-10-14
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Crystal Structure of Non-Structural Protein 10 from Severe Acute Respiratory Syndrome Coronavirus-2.
Int J Mol Sci, 21, 2020
3K2L
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BU of 3k2l by Molmil
Crystal Structure of dual-specificity tyrosine phosphorylation regulated kinase 2 (DYRK2)
Descriptor: CHLORIDE ION, Dual specificity tyrosine-phosphorylation-regulated kinase 2, SODIUM ION, ...
Authors:Filippakopoulos, P, Myrianthopoulos, V, Soundararajan, M, Krojer, T, Hapka, E, Fedorov, O, Berridge, G, Wang, J, Shrestha, L, Pike, A.C.W, Ugochukwu, E, von Delft, F, Arrowsmith, C.H, Edwards, A, Weigelt, J, Bountra, C, Mikros, E, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2009-09-30
Release date:2009-10-13
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Structures of Down Syndrome Kinases, DYRKs, Reveal Mechanisms of Kinase Activation and Substrate Recognition.
Structure, 21, 2013
3K2V
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BU of 3k2v by Molmil
Structure of the CBS pair of a putative D-arabinose 5-phosphate isomerase from Klebsiella pneumoniae subsp. pneumoniae.
Descriptor: CYTIDINE 5'-MONOPHOSPHATE 3-DEOXY-BETA-D-GULO-OCT-2-ULO-PYRANOSONIC ACID, GLYCEROL, SULFATE ION, ...
Authors:Cuff, M.E, Volkart, L, Bearden, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-09-30
Release date:2009-12-22
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structure of the CBS pair of a putative D-arabinose 5-phosphate isomerase from Klebsiella pneumoniae subsp. pneumoniae.
TO BE PUBLISHED
3K3F
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BU of 3k3f by Molmil
Crystal Structure of the Urea Transporter from Desulfovibrio Vulgaris
Descriptor: GOLD ION, Urea transporter
Authors:Levin, E.J, Zhou, M, New York Consortium on Membrane Protein Structure (NYCOMPS)
Deposit date:2009-10-02
Release date:2009-11-17
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of a bacterial homologue of the kidney urea transporter.
Nature, 462, 2009
3K3P
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BU of 3k3p by Molmil
Crystal Structure of the Apo Form of D-Alanine:D-Alanine Ligase (DDl) from Streptococcus mutans
Descriptor: D-alanine--D-alanine ligase
Authors:Lu, Y.
Deposit date:2009-10-03
Release date:2010-09-15
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.23 Å)
Cite:Crystal structure of the Apo form of D-Alanine:D-Alanine ligase (DDl) from Streptococcus mutans.
Protein Pept.Lett., 17, 2010
6ZTU
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Crystal structure of a cyclodipeptide synthase from Bacillus thermoamylovorans
Descriptor: (2S)-hexane-1,2-diol, Cyclodipeptide synthase, BtCDPS
Authors:Harding, C.J, Czekster, C.M.
Deposit date:2020-07-20
Release date:2021-01-27
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Bypassing the requirement for aminoacyl-tRNA by a cyclodipeptide synthase enzyme.
Rsc Chem Biol, 2, 2021

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數據於2025-10-15公開中

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