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5I5M
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BU of 5i5m by Molmil
Shewanella denitrificans nitrous oxide reductase, Ca2+-reconstituted form
分子名称: (R,R)-2,3-BUTANEDIOL, CALCIUM ION, Nitrous-oxide reductase, ...
著者Schneider, L.K, Einsle, O.
登録日2016-02-15
公開日2016-03-02
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Role of Calcium in Secondary Structure Stabilization during Maturation of Nitrous Oxide Reductase.
Biochemistry, 55, 2016
6HMQ
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BU of 6hmq by Molmil
STRUCTURE OF PROTEIN KINASE CK2 CATALYTIC SUBUNIT (ISOFORM CK2ALPHA'; CSNK2A2 GENE PRODUCT) IN COMPLEX WITH THE BENZOTRIAZOLE-TYPE INHIBITOR MB002
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-(4,5,6,7-tetrabromo-1H-benzotriazol-1-yl)propan-1-ol, ...
著者Niefind, K, Lindenblatt, D, Applegate, V.M, Jose, J, Le Borgne, M.
登録日2018-09-12
公開日2019-03-27
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (0.97 Å)
主引用文献Diacritic Binding of an Indenoindole Inhibitor by CK2 alpha Paralogs Explored by a Reliable Path to Atomic Resolution CK2 alpha ' Structures.
Acs Omega, 4, 2019
7LOX
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BU of 7lox by Molmil
The structure of Agmatinase from E. Coli at 3.2 A displaying guanidine in the active site
分子名称: Agmatinase, GUANIDINE, MANGANESE (II) ION
著者Maturana, P, Figueroa, M, Gonzalez-Ordenes, F, Villalobos, P, Martinez-Oyanedel, J, Uribe, E.A, Castro-Fernandez, V.
登録日2021-02-11
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Crystal Structure of Escherichia coli Agmatinase: Catalytic Mechanism and Residues Relevant for Substrate Specificity.
Int J Mol Sci, 22, 2021
6D32
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BU of 6d32 by Molmil
Crystal structure of Xenopus Smoothened in complex with cyclopamine
分子名称: Cyclopamine, Smoothened,Soluble cytochrome b562,Smoothened
著者Huang, P, Zheng, S, Kim, Y, Kruse, A.C, Salic, A.
登録日2018-04-14
公開日2018-05-23
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.751 Å)
主引用文献Structural Basis of Smoothened Activation in Hedgehog Signaling.
Cell, 174, 2018
5IEH
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BU of 5ieh by Molmil
Structure of HLA-B*40:02 in complex with the phosphorylated endogenous peptide REF(p)SKEPEL
分子名称: 1,2-ETHANEDIOL, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
著者Alpizar, A, Marcilla, M, Santiago, C.
登録日2016-02-25
公開日2016-12-07
最終更新日2019-10-16
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structure of HLA-B*40:02 in complex with the phosphorilated endogenous peptide REFpSKEPEL
To Be Published
7LUO
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BU of 7luo by Molmil
N-terminus of Skp2 bound to Cyclin A
分子名称: S-phase kinase-associated protein 2,Cyclin-A2, Skp2 Motif 1 uncharacterized fragment 1, Skp2 Motif 1 uncharacterized fragment 2
著者Kelso, S, Ceccarelli, D.F, Sicheri, F.
登録日2021-02-22
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (3.17 Å)
主引用文献Bipartite binding of the N terminus of Skp2 to cyclin A.
Structure, 29, 2021
6HNL
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BU of 6hnl by Molmil
Selenomethionine derivative of IdmH 96-104 loop truncation variant
分子名称: Putative polyketide cyclase IdmH
著者Drulyte, I, Obajdin, J, Trinh, C, Hemsworth, G.R, Berry, A.
登録日2018-09-16
公開日2019-11-06
最終更新日2019-11-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Crystal structure of the putative cyclase IdmH from the indanomycin nonribosomal peptide synthase/polyketide synthase.
Iucrj, 6, 2019
5UC7
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BU of 5uc7 by Molmil
Crystal structure of BioA / 7,8-diaminopelargonic acid aminotransferase / DAPA synthase from Citrobacter rodentium, PLP complex
分子名称: Adenosylmethionine-8-amino-7-oxononanoate aminotransferase, D(-)-TARTARIC ACID
著者Stogios, P.J, Evdokimova, E, Di Leo, R, Savchenko, A, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2016-12-21
公開日2017-01-25
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.835 Å)
主引用文献Crystal structure of BioA / 7,8-diaminopelargonic acid aminotransferase / DAPA synthase from Citrobacter rodentium, PLP complex
To Be Published
7LRQ
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BU of 7lrq by Molmil
Crystal structure of human SFPQ/NONO heterodimer, conserved DBHS region
分子名称: CHLORIDE ION, Non-POU domain-containing octamer-binding protein, Splicing factor, ...
著者Marshall, A.C, Bond, C.S, Mohnen, I.
登録日2021-02-17
公開日2021-05-12
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Paraspeckle subnuclear bodies depend on dynamic heterodimerisation of DBHS RNA-binding proteins via their structured domains.
J.Biol.Chem., 298, 2022
6HVO
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BU of 6hvo by Molmil
Crystal structure of human PCNA in complex with three peptides of p12 subunit of human polymerase delta
分子名称: DNA polymerase delta subunit 4, Proliferating cell nuclear antigen, SULFATE ION
著者Gonzalez-Magana, A, Romano-Moreno, M, Rojas, A.L, Blanco, F.J, De Biasio, A.
登録日2018-10-11
公開日2019-01-23
最終更新日2019-03-27
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The p12 subunit of human polymerase delta uses an atypical PIP box for molecular recognition of proliferating cell nuclear antigen (PCNA).
J.Biol.Chem., 294, 2019
7LRU
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BU of 7lru by Molmil
Crystal structure of SFPQ-NONO-SFPQ chimeric protein homodimer
分子名称: Splicing factor, proline- and glutamine-rich,Isoform 2 of Non-POU domain-containing octamer-binding protein,Isoform Short of Splicing factor, proline- and glutamine-rich
著者Marshall, A.C, Bond, C.S, Mohnen, I, Knott, G.J.
登録日2021-02-17
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structure of SFPQ-NONO-SFPQ chimeric protein homodimer
To Be Published
5I0S
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BU of 5i0s by Molmil
Thiosulfate bound Cysteine Dioxygenase at pH 6.2
分子名称: Cysteine dioxygenase type 1, FE (III) ION, THIOSULFATE
著者Kean, K.M, Driggers, C.M, Karplus, P.A.
登録日2016-02-04
公開日2016-12-14
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structure-Based Insights into the Role of the Cys-Tyr Crosslink and Inhibitor Recognition by Mammalian Cysteine Dioxygenase.
J. Mol. Biol., 428, 2016
7LOL
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BU of 7lol by Molmil
The structure of Agmatinase from E. Coli at 1.8 A displaying urea and agmatine
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, AGMATINE, Agmatinase, ...
著者Maturana, P, Figueroa, M, Gonzalez-Ordenes, F, Villalobos, P, Martinez-Oyanedel, J, Uribe, E.A, Castro-Fernandez, V.
登録日2021-02-10
公開日2021-05-12
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structure of Escherichia coli Agmatinase: Catalytic Mechanism and Residues Relevant for Substrate Specificity.
Int J Mol Sci, 22, 2021
5TRV
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BU of 5trv by Molmil
Crystal structure of a de novo designed protein with curved beta-sheet
分子名称: DI(HYDROXYETHYL)ETHER, denovo NTF2
著者Basanta, B, Oberdorfer, G, Marcos, E, Chidyausiku, T.M, Sankaran, B, Baker, D.
登録日2016-10-27
公開日2017-01-25
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.91 Å)
主引用文献Principles for designing proteins with cavities formed by curved beta sheets.
Science, 355, 2017
6HXQ
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BU of 6hxq by Molmil
Structure of citryl-CoA synthetase from Hydrogenobacter thermophilus
分子名称: CITRATE ANION, COENZYME A, Citryl-CoA synthetase large subunit, ...
著者Verstraete, K, Verschueren, K.
登録日2018-10-17
公開日2019-04-10
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.91 Å)
主引用文献Structure of ATP citrate lyase and the origin of citrate synthase in the Krebs cycle.
Nature, 568, 2019
5I9S
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BU of 5i9s by Molmil
MicroED structure of proteinase K at 1.75 A resolution
分子名称: Proteinase K, SULFATE ION
著者Hattne, J, Shi, D, de la Cruz, M.J, Reyes, F.E, Gonen, T.
登録日2016-02-20
公開日2016-06-08
最終更新日2023-08-30
実験手法ELECTRON CRYSTALLOGRAPHY (1.75 Å)
主引用文献Modeling truncated pixel values of faint reflections in MicroED images.
J.Appl.Crystallogr., 49, 2016
6HYC
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BU of 6hyc by Molmil
The structure of full-length human phenylalanine hydroxylase in complex with the cofactor and negative regulator tetrahydrobiopterin
分子名称: 5,6,7,8-TETRAHYDROBIOPTERIN, Phenylalanine-4-hydroxylase
著者Alcorlo Pages, M, Flydal, I.M.
登録日2018-10-19
公開日2019-06-05
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.18 Å)
主引用文献Structure of full-length human phenylalanine hydroxylase in complex with tetrahydrobiopterin.
Proc.Natl.Acad.Sci.USA, 116, 2019
7LNO
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BU of 7lno by Molmil
Structure of apo-CDD-1 beta-lactamase in imidazole and MPD
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, Beta-lactamase, SULFATE ION
著者Smith, C.A, Vakulenko, S.B, Stewart, N.K.
登録日2021-02-08
公開日2021-05-12
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献In Crystallo Time-Resolved Interaction of the Clostridioides difficile CDD-1 enzyme with Avibactam Provides New Insights into the Catalytic Mechanism of Class D beta-lactamases.
Acs Infect Dis., 7, 2021
6HQ9
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BU of 6hq9 by Molmil
Crystal structure of the Tudor domain of human ERCC6-L2
分子名称: DNA excision repair protein ERCC-6-like 2
著者Newman, J.A, Gavard, A.E, Nathan, W.J, Pinkas, D.M, von Delft, F, Arrowsmith, C.H, Edwards, A, Bountra, C, Gileadi, O.
登録日2018-09-24
公開日2018-10-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.982 Å)
主引用文献Crystal structure of the Tudor domain of human ERCC6-L2
To Be Published
7LNQ
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BU of 7lnq by Molmil
Structure of the avibactam-CDD-1 3 minute complex in imidazole and MPD
分子名称: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, (4S)-2-METHYL-2,4-PENTANEDIOL, Beta-lactamase, ...
著者Smith, C.A, Vakulenko, S.B, Stewart, N.K.
登録日2021-02-08
公開日2021-05-12
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献In Crystallo Time-Resolved Interaction of the Clostridioides difficile CDD-1 enzyme with Avibactam Provides New Insights into the Catalytic Mechanism of Class D beta-lactamases.
Acs Infect Dis., 7, 2021
6HQD
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BU of 6hqd by Molmil
Cytochrome P450-153 from Pseudomonas sp. 19-rlim
分子名称: Cytochrome P450, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Fiorentini, F, Mattevi, A.
登録日2018-09-24
公開日2018-12-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The Extreme Structural Plasticity in the CYP153 Subfamily of P450s Directs Development of Designer Hydroxylases.
Biochemistry, 57, 2018
6CMC
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BU of 6cmc by Molmil
Barium sites in the structure of a desensitized acid sensing ion channel
分子名称: Acid-sensing ion channel 1, CHLORIDE ION
著者Yoder, N, Gouaux, E.
登録日2018-03-03
公開日2018-08-08
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.671 Å)
主引用文献Divalent cation and chloride ion sites of chicken acid sensing ion channel 1a elucidated by x-ray crystallography.
PLoS ONE, 13, 2018
5UL1
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BU of 5ul1 by Molmil
The co-structure of 3-amino-6-(4-((1-(dimethylamino)propan-2-yl)sulfonyl)phenyl)-N-phenylpyrazine-2-carboxamide and a rationally designed PI3K-alpha mutant that mimics ATR
分子名称: 3-amino-6-(4-{[(2S)-1-(dimethylamino)propan-2-yl]sulfonyl}phenyl)-N-phenylpyrazine-2-carboxamide, Phosphatidylinositol 3-kinase regulatory subunit alpha, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
著者Knapp, M.S, Elling, R.A, Mamo, M.
登録日2017-01-23
公開日2017-05-10
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Rationally Designed PI3K alpha Mutants to Mimic ATR and Their Use to Understand Binding Specificity of ATR Inhibitors.
J. Mol. Biol., 429, 2017
5I2U
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BU of 5i2u by Molmil
Crystal structure of a novel Halo-Tolerant Cellulase from Soil Metagenome
分子名称: Cellulase, GLYCEROL, MAGNESIUM ION, ...
著者Garg, R, Brahma, V, Srivastava, R, Verma, L, Karthikeyan, S, Sahni, G.
登録日2016-02-09
公開日2017-01-18
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Biochemical and structural characterization of a novel halotolerant cellulase from soil metagenome
Sci Rep, 6, 2016
6CMQ
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Structure of human SHP2 without N-SH2 domain
分子名称: Tyrosine-protein phosphatase non-receptor type 11
著者Padua, R.A.P, Sun, Y, Marko, I, Pitsawong, W, Kern, D.
登録日2018-03-06
公開日2018-11-14
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Mechanism of activating mutations and allosteric drug inhibition of the phosphatase SHP2.
Nat Commun, 9, 2018

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