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4U72
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BU of 4u72 by Molmil
Crystal structure of 4-phenylimidazole bound form of human indoleamine 2,3-dioxygenase (A260G mutant)
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, 4-PHENYL-1H-IMIDAZOLE, Indoleamine 2,3-dioxygenase 1, ...
Authors:Sugimoto, H, Horitani, M, Kometani, E, Shiro, Y.
Deposit date:2014-07-30
Release date:2015-09-02
Last modified:2020-01-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Conformation and Mobility of Active Site Loop is Critical for Substrate Binding and Inhibition in Human Indoleamine 2,3-Dioxygenase
to be published
8H78
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BU of 8h78 by Molmil
Crystal structure of human MMP-2 catalytic domain in complex with inhibitor
Descriptor: (2~{R})-2-[[4-[(4-aminocarbonylphenyl)carbonylamino]phenyl]sulfonylamino]-5-[(2~{S},4~{S})-4-azanyl-2-[[(2~{S})-1-[[(2~{S})-1-[(5-azanyl-5-oxidanylidene-pentyl)amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid, CALCIUM ION, DIHYDROGENPHOSPHATE ION, ...
Authors:Kamitani, M, Takeuchi, T, Mima, M.
Deposit date:2022-10-19
Release date:2023-01-18
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Discovery of TP0597850: A Selective, Chemically Stable, and Slow Tight-Binding Matrix Metalloproteinase-2 Inhibitor with a Phenylbenzamide-Pentapeptide Hybrid Scaffold.
J.Med.Chem., 66, 2023
8IP9
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BU of 8ip9 by Molmil
Wheat 40S ribosome in complex with a tRNAi
Descriptor: 18S ribosomal RNA, 40S ribosomal protein S23, 40S ribosomal protein eS1, ...
Authors:Yokoyama, T, Tanaka, M, Saito, H, Nishimoto, M, Tsuda, K, Sotta, N, Shigematsu, H, Shirouzu, M, Iwasaki, S, Ito, T, Fujiwara, T.
Deposit date:2023-03-14
Release date:2024-02-21
Last modified:2024-05-15
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Boric acid intercepts 80S ribosome migration from AUG-stop by stabilizing eRF1.
Nat.Chem.Biol., 20, 2024
5NYX
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BU of 5nyx by Molmil
human Fab fragment 5H2 against NHBA from Neisseria meningitidis
Descriptor: GLYCEROL, HEAVY CHAIN, LIGHT CHAIN, ...
Authors:Malito, E, Maritan, M.
Deposit date:2017-05-12
Release date:2018-05-30
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Structures of NHBA elucidate a broadly conserved epitope identified by a vaccine induced antibody.
PLoS ONE, 13, 2018
5O1R
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BU of 5o1r by Molmil
human Fab 5H2 bound to NHBA-C3 from Neisseria meningitidis serogroup B
Descriptor: 1,2-ETHANEDIOL, GNA2132, IGH@ protein, ...
Authors:Malito, E, Maritan, M.
Deposit date:2017-05-19
Release date:2018-05-30
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.86 Å)
Cite:Structures of NHBA elucidate a broadly conserved epitope identified by a vaccine induced antibody.
PLoS ONE, 13, 2018
7XJO
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BU of 7xjo by Molmil
Crystal structure of human MMP-2 catalytic domain in complex with inhibitor
Descriptor: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, CHLORIDE ION, ...
Authors:Kamitani, M, Mima, M, Takeuchi, T.
Deposit date:2022-04-18
Release date:2022-06-29
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Discovery of Aryloxyphenyl-Heptapeptide Hybrids as Potent and Selective Matrix Metalloproteinase-2 Inhibitors for the Treatment of Idiopathic Pulmonary Fibrosis.
J.Med.Chem., 65, 2022
7XGJ
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BU of 7xgj by Molmil
Crystal structure of human MMP-2 catalytic domain in complex with inhibitor
Descriptor: CALCIUM ION, GZS-ASN-ASP-ALA-LEU-IML-EOE-NH2, Matrix metalloproteinase-2, ...
Authors:Kamitani, M, Mima, M, Takeuchi, T.
Deposit date:2022-04-05
Release date:2022-06-29
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Discovery of Aryloxyphenyl-Heptapeptide Hybrids as Potent and Selective Matrix Metalloproteinase-2 Inhibitors for the Treatment of Idiopathic Pulmonary Fibrosis.
J.Med.Chem., 65, 2022
7WXX
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BU of 7wxx by Molmil
Crystal structure of human MMP-7 in complex with inhibitor
Descriptor: CALCIUM ION, Matrilysin, Peptide Inhibitor, ...
Authors:Kamitani, M, Oka, Y, Tabuse, H.
Deposit date:2022-02-15
Release date:2022-10-05
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Discovery of Highly Potent and Selective Matrix Metalloproteinase-7 Inhibitors by Hybridizing the S1' Subsite Binder with Short Peptides.
J.Med.Chem., 65, 2022
3VU3
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BU of 3vu3 by Molmil
Crystal structure of the Hfq and catalase HPII complex
Descriptor: Catalase HPII, PROTOPORPHYRIN IX CONTAINING FE, Protein hfq
Authors:Watanabe, M, Yonekura, K.
Deposit date:2012-06-15
Release date:2013-11-20
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Post-Transcriptional Regulator Hfq Binds Catalase HPII: Crystal Structure of the Complex
Plos One, 8, 2013
5XGZ
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BU of 5xgz by Molmil
Metagenomic glucose-tolerant glycosidase
Descriptor: Beta-glycosidase, GLYCEROL, NICKEL (II) ION, ...
Authors:Watanabe, M, Matsuzawa, T, Yaoi, K.
Deposit date:2017-04-19
Release date:2018-05-02
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Improved thermostability of a metagenomic glucose-tolerant beta-glycosidase based on its X-ray crystal structure.
Appl.Microbiol.Biotechnol., 101, 2017
2ZA0
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BU of 2za0 by Molmil
Crystal structure of mouse glyoxalase I complexed with methyl-gerfelin
Descriptor: Glyoxalase I, ZINC ION, methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate
Authors:Okumura, H, Kawatani, M, Osada, H.
Deposit date:2007-09-26
Release date:2008-08-12
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The identification of an osteoclastogenesis inhibitor through the inhibition of glyoxalase I
Proc.Natl.Acad.Sci.Usa, 105, 2008
7WDO
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BU of 7wdo by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: Beta-glucosidase, SULFATE ION, beta-D-glucopyranose, ...
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.21 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides
Appl.Microbiol.Biotechnol., 106, 2022
7WDR
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BU of 7wdr by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: 4-nitrophenyl beta-D-glucopyranoside, Beta-glucosidase, SULFATE ION
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides
Appl.Microbiol.Biotechnol., 106, 2022
7WDP
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BU of 7wdp by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: Beta-glucosidase, SULFATE ION, alpha-D-glucopyranose, ...
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides
Appl.Microbiol.Biotechnol., 106, 2022
7WDS
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BU of 7wds by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: Beta-glucosidase, SULFATE ION, beta-D-xylopyranose
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides
Appl.Microbiol.Biotechnol., 106, 2022
7WDV
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BU of 7wdv by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: Beta-glucosidase, SULFATE ION, beta-D-glucopyranose, ...
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.812 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides
Appl.Microbiol.Biotechnol., 106, 2022
7WDN
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BU of 7wdn by Molmil
Crystal structures of MeBglD2 in complex with various saccharides
Descriptor: alpha-D-glucopyranose, beta-glucosidase
Authors:Watanabe, M, Matsuzawa, T, Nakamichi, Y, Akita, H, Yaoi, K.
Deposit date:2021-12-22
Release date:2023-01-04
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of metagenomic beta-glycosidase MeBglD2 in complex with various saccharides.
Appl.Microbiol.Biotechnol., 106, 2022
2E3U
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BU of 2e3u by Molmil
Crystal structure analysis of Dim2p from Pyrococcus horikoshii OT3
Descriptor: Hypothetical protein PH1566
Authors:Tanokura, M, Jia, M.Z.
Deposit date:2006-11-29
Release date:2007-10-23
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of Dim2p: a preribosomal RNA processing factor, from Pyrococcus horikoshii OT3 at 2.30 A
Proteins, 69, 2007
3A4T
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BU of 3a4t by Molmil
Crystal structure of aTrm4 from M.jannaschii with sinefungin
Descriptor: Putative methyltransferase MJ0026, SINEFUNGIN
Authors:Hirano, M, Kuratani, M, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2009-07-14
Release date:2010-06-30
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of Methanocaldococcus jannaschii Trm4 complexed with sinefungin.
J.Mol.Biol., 401, 2010
2ROR
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BU of 2ror by Molmil
Solution structure of the VAV1 SH2 domain complexed with a tyrosine-phosphorylated peptide from SLP76
Descriptor: 15-meric peptide from Lymphocyte cytosolic protein 2, Proto-oncogene vav
Authors:Tanaka, M, Kasai, T, Koshiba, S, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2008-04-08
Release date:2009-04-21
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:Solution structure of the VAV1 SH2 domain complexed with a tyrosine-phosphorylated peptide from SLP76
To be Published
3AJD
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BU of 3ajd by Molmil
Crystal structure of ATRM4
Descriptor: GLYCEROL, ISOPROPYL ALCOHOL, Putative methyltransferase MJ0026
Authors:Hirano, M, Kuratani, M, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2010-06-01
Release date:2010-06-30
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.27 Å)
Cite:Crystal structure of Methanocaldococcus jannaschii Trm4 complexed with sinefungin.
J.Mol.Biol., 401, 2010
5XHF
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BU of 5xhf by Molmil
Crystal structure of Trastuzumab Fab fragment bearing p-azido-L-phenylalanine
Descriptor: polypeptide (H chain), polypeptide (L chain)
Authors:Kuratani, M, Yanagisawa, T, Sakamoto, K, Yokoyama, S.
Deposit date:2017-04-20
Release date:2017-12-20
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.205 Å)
Cite:Extensive Survey of Antibody Invariant Positions for Efficient Chemical Conjugation Using Expanded Genetic Codes.
Bioconjug. Chem., 28, 2017
5YHS
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BU of 5yhs by Molmil
Pyruvylated beta-D-galactosidase from Bacillus sp. HMA207, apo form
Descriptor: Pyruvylated beta-D-galactosidase
Authors:Tanuma, M, Yamada, C, Arakawa, T, Higuchi, Y, Takegawa, K, Fushinobu, S.
Deposit date:2017-09-29
Release date:2018-08-29
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Identification and characterization of a novel beta-D-galactosidase that releases pyruvylated galactose.
Sci Rep, 8, 2018
5YIF
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BU of 5yif by Molmil
Pyruvylated beta-D-galactosidase from Bacillus sp. HMA207, E163A mutant pyruvylated beta-D-galactose complex
Descriptor: (2R,4aR,6R,7R,8R,8aR)-2-methyl-6,7,8-tris(oxidanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-2-carboxylic acid, Pyruvylated beta-D-galactosidase
Authors:Tanuma, M, Yamada, C, Arakawa, T, Higuchi, Y, Takegawa, K, Fushinobu, S.
Deposit date:2017-10-04
Release date:2018-08-29
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Identification and characterization of a novel beta-D-galactosidase that releases pyruvylated galactose.
Sci Rep, 8, 2018
5XHG
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BU of 5xhg by Molmil
Crystal structure of Trastuzumab Fab fragment bearing Ne-(o-azidobenzyloxycarbonyl)-L-lysine
Descriptor: (2-azidophenyl)methyl hydrogen carbonate, 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, ...
Authors:Kuratani, M, Yanagisawa, T, Sakamoto, K, Yokoyama, S.
Deposit date:2017-04-20
Release date:2017-12-20
Last modified:2019-12-25
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Extensive Survey of Antibody Invariant Positions for Efficient Chemical Conjugation Using Expanded Genetic Codes.
Bioconjug. Chem., 28, 2017

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