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6H1B
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Structure of amide bond synthetase Mcba K483A mutant from Marinactinospora thermotolerans
分子名称: 1-ethanoyl-9~{H}-pyrido[3,4-b]indole-3-carboxylic acid, ADENOSINE MONOPHOSPHATE, Fatty acid CoA ligase
著者Rowlinson, B, Petchey, M, Cuetos, A, Frese, A, Dannevald, S, Grogan, G.
登録日2018-07-11
公開日2018-09-05
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献The Broad Aryl Acid Specificity of the Amide Bond Synthetase McbA Suggests Potential for the Biocatalytic Synthesis of Amides.
Angew. Chem. Int. Ed. Engl., 57, 2018
6B5B
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BU of 6b5b by Molmil
Cryo-EM structure of the NAIP5-NLRC4-flagellin inflammasome
分子名称: Baculoviral IAP repeat-containing protein 1e, Flagellin, NLR family CARD domain-containing protein 4
著者Tenthorey, J.L, Haloupek, N, Lopez-Blanco, J.R, Grob, P, Adamson, E, Hartenian, E, Lind, N.A, Bourgeois, N.M, Chacon, P, Nogales, E, Vance, R.E.
登録日2017-09-29
公開日2017-11-15
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (5.2 Å)
主引用文献The structural basis of flagellin detection by NAIP5: A strategy to limit pathogen immune evasion.
Science, 358, 2017
5FJO
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BU of 5fjo by Molmil
N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: G291D- F323Y mutant in complex with N-acetyl naphthylalanine
分子名称: MAGNESIUM ION, N-acetyl naphthylalanine, N-succinylamino acid racemase
著者Sanchez-Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.08 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
4L6E
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BU of 4l6e by Molmil
Crystal Structure of the RanBD1 fourth domain of E3 SUMO-protein ligase RanBP2. Northeast Structural Genomics Consortium (NESG) Target HR9193b
分子名称: E3 SUMO-protein ligase RanBP2
著者Vorobiev, S, Su, M, Seetharaman, J, Mao, L, Xiao, R, Maglaqui, M, Kogan, S, Wang, H, Everett, J.K, Acton, T.B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG)
登録日2013-06-12
公開日2013-06-26
実験手法X-RAY DIFFRACTION (2.496 Å)
主引用文献Crystal Structure of the RanBD1 fourth domain of E3 SUMO-protein ligase RanBP2.
To be Published
5A4W
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BU of 5a4w by Molmil
AtGSTF2 from Arabidopsis thaliana in complex with quercetrin
分子名称: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside, ACETATE ION, GLUTATHIONE S-TRANSFERASE F2
著者Ahmad, L, Rylott, E, Bruce, N.C, Edwards, R, Grogan, G.
登録日2015-06-15
公開日2016-06-29
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Structural evidence for Arabidopsis glutathione transferase AtGSTF2 functioning as a transporter of small organic ligands.
FEBS Open Bio, 7, 2017
5A9T
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Imine Reductase from Amycolatopsis orientalis in complex with (R)- Methyltetrahydroisoquinoline
分子名称: (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, ACETATE ION, CALCIUM ION, ...
著者Man, H, Aleku, G, Turner, N.J, Grogan, G.
登録日2015-07-22
公開日2016-06-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
4LLJ
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BU of 4llj by Molmil
Crystal structure of PDE10A2 with fragment ZT214
分子名称: 2H-isoindole-1,3-diamine, NICKEL (II) ION, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
著者Sridhar, V, Badger, J, Logan, C, Chie-Leon, B, Nienaber, V.
登録日2013-07-09
公開日2014-02-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.56 Å)
主引用文献Identification and Optimization of PDE10A Inhibitors Using Fragment-Based Screening by Nanocalorimetry and X-ray Crystallography.
J Biomol Screen, 19, 2014
4LM0
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BU of 4lm0 by Molmil
Crystal structure of PDE10A2 with fragment ZT448
分子名称: 5-NITROINDAZOLE, NICKEL (II) ION, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
著者Sridhar, V, Badger, J, Logan, C, Chie-Leon, B, Nienaber, V.
登録日2013-07-09
公開日2014-02-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Identification and Optimization of PDE10A Inhibitors Using Fragment-Based Screening by Nanocalorimetry and X-ray Crystallography.
J Biomol Screen, 19, 2014
7DXI
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BU of 7dxi by Molmil
Structure of Drosophila melanogaster GlcNAc-1-phosphotransferase
分子名称: CALCIUM ION, FI02838p
著者Du, S, Xiao, J, Guopeng, W.
登録日2021-01-19
公開日2022-02-02
最終更新日2022-08-17
実験手法ELECTRON MICROSCOPY (3.53 Å)
主引用文献Structural insights into how GlcNAc-1-phosphotransferase directs lysosomal protein transport.
J.Biol.Chem., 298, 2022
5FJR
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BU of 5fjr by Molmil
N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: Q26A M50I G291D F323Y mutant in complex with N-acetyl napthylalanine
分子名称: MAGNESIUM ION, N-acetyl naphthylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
5FR9
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BU of 5fr9 by Molmil
Structure of transaminase ATA-117 arRmut11 from Arthrobacter sp. KNK168 inhibited with 1-(4-Bromophenyl)-2-fluoroethylamine
分子名称: (R)-AMINE TRANSAMINASE, [4-[3-(4-bromophenyl)-3-oxidanylidene-propyl]-6-methyl-5-oxidanyl-pyridin-3-yl]methyl phosphate
著者Cuetos, A, Kroutil, W, Lavandera, I, Grogan, G.
登録日2015-12-16
公開日2016-03-02
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.81 Å)
主引用文献Catalytic Promiscuity of Transaminases: Preparation of Enantioenriched Beta-Fluoroamines by Formal Tandem Hydrodefluorination/Deamination.
Angew.Chem.Int.Ed.Engl., 55, 2016
4LLK
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BU of 4llk by Molmil
Crystal structure of PDE10A2 with fragment ZT217
分子名称: 2-methylquinazolin-4(3H)-one, NICKEL (II) ION, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
著者Sridhar, V, Badger, J, Logan, C, Chie-Leon, B, Nienaber, V.
登録日2013-07-09
公開日2014-02-26
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Identification and Optimization of PDE10A Inhibitors Using Fragment-Based Screening by Nanocalorimetry and X-ray Crystallography.
J Biomol Screen, 19, 2014
6GVC
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BU of 6gvc by Molmil
Structure of ArhGAP12 bound to G-Actin
分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-TRIPHOSPHATE, Actin, ...
著者Mouilleron, S, Treisman, R, Diring, J.
登録日2018-06-20
公開日2019-03-27
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献RPEL-family rhoGAPs link Rac/Cdc42 GTP loading to G-actin availability.
Nat.Cell Biol., 21, 2019
5FJP
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BU of 5fjp by Molmil
N-acyl amino acid racemase from Amycolatopsis sp Ts-1-60: G291D F323Y I293G mutant in complex with N-acetyl naphthylalanine
分子名称: MAGNESIUM ION, N-acetyl naphthylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
5FWN
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BU of 5fwn by Molmil
Imine Reductase from Amycolatopsis orientalis. Closed form in in complex with (R)- Methyltetrahydroisoquinoline
分子名称: (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, IMINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Man, H, Aleku, G, Turner, N.J, Grogan, G.
登録日2016-02-18
公開日2016-06-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.14 Å)
主引用文献Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
6I04
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BU of 6i04 by Molmil
Crystal structure of Sema domain of the Met receptor in complex with FAB
分子名称: Fab heavy chain, Fab light chain, Hepatocyte growth factor receptor
著者Casaletto, J.B, Geddie, M.L, Abu-Yousif, A.O, Masson, K, Fulgham, A, Boudot, A, Maiwald, T, Kearns, J.D, Kohli, N, Su, S, Razlog, M, Raue, A, Kalra, A, Hakansson, M, Logan, D.T, Welin, M, Chattopadhyay, S, Harms, B.D, Nielsen, U.B, Schoeberl, B, Lugovskoy, A.A, MacBeath, G.
登録日2018-10-25
公開日2019-03-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献MM-131, a bispecific anti-Met/EpCAM mAb, inhibits HGF-dependent and HGF-independent Met signaling through concurrent binding to EpCAM.
Proc.Natl.Acad.Sci.USA, 116, 2019
4XCR
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BU of 4xcr by Molmil
Monomeric Human Cu,Zn Superoxide dismutase, loops IV and VII deleted, apo form, mutant I35A
分子名称: Superoxide dismutase [Cu-Zn]
著者Wang, H, Logan, D.T, Danielsson, J, Mu, X, Binolfi, A, Theillet, F, Bekei, B, Lang, L, Wennerstrom, H, Selenko, P, Oliveberg, M.
登録日2014-12-18
公開日2016-01-20
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.602 Å)
主引用文献Thermodynamics of protein destabilization in live cells.
Proc. Natl. Acad. Sci. U.S.A., 112, 2015
6HF2
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BU of 6hf2 by Molmil
The structure of BoMan26B, a GH26 beta-mannanase from Bacteroides ovatus
分子名称: CALCIUM ION, CHLORIDE ION, Glycosyl hydrolase family 26
著者Bagenholm, V, Logan, D.T, Stalbrand, H.
登録日2018-08-21
公開日2019-04-24
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献A surface-exposed GH26 beta-mannanase fromBacteroides ovatus: Structure, role, and phylogenetic analysis ofBoMan26B.
J.Biol.Chem., 294, 2019
6HF4
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BU of 6hf4 by Molmil
The structure of BoMan26B, a GH26 beta-mannanase from Bacteroides ovatus, complexed with G1M4
分子名称: CALCIUM ION, CHLORIDE ION, Glycosyl hydrolase family 26, ...
著者Bagenholm, V, Logan, D.T, Stalbrand, H.
登録日2018-08-21
公開日2019-04-24
最終更新日2024-05-15
実験手法X-RAY DIFFRACTION (1.781 Å)
主引用文献A surface-exposed GH26 beta-mannanase fromBacteroides ovatus: Structure, role, and phylogenetic analysis ofBoMan26B.
J.Biol.Chem., 294, 2019
6HGN
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BU of 6hgn by Molmil
Crystal structure of Alpha1-antichymotrypsin variant DBS-II-allo-L55V: an allosterically controlled doxorubicin-binding serpin with an unprecedentedly high ligand release efficacy
分子名称: 1,2-ETHANEDIOL, Alpha-1-antichymotrypsin
著者Schmidt, K, Muller, Y.A.
登録日2018-08-23
公開日2019-05-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.478 Å)
主引用文献NewBG: A surrogate corticosteroid-binding globulin with an unprecedentedly high ligand release efficacy.
J.Struct.Biol., 207, 2019
4Y04
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BU of 4y04 by Molmil
Crystal structure of dipeptidyl peptidase 11 (DPP11) from Porphyromonas gingivalis (Space)
分子名称: GLYCEROL, POTASSIUM ION, Peptidase S46
著者Sakamoto, Y, Suzuki, Y, Iizuka, I, Tateoka, C, Roppongi, S, Fujimoto, M, Inaka, K, Tanaka, H, Yamada, M, Ohta, K, Nonaka, T, Ogasawara, W, Tanaka, N.
登録日2015-02-05
公開日2015-07-15
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Structural and mutational analyses of dipeptidyl peptidase 11 from Porphyromonas gingivalis reveal the molecular basis for strict substrate specificity.
Sci Rep, 5, 2015
4MSH
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BU of 4msh by Molmil
Crystal Structure of PDE10A2 with fragment ZT0143 ((2S)-4-chloro-2,3-dihydro-1,3-benzothiazol-2-amine)
分子名称: 4-chloro-1,3-benzothiazol-2-amine, NICKEL (II) ION, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
著者Sridhar, V, Badger, J, Logan, C, Chie-Leon, B, Nienaber, V.
登録日2013-09-18
公開日2014-05-14
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Identification and optimization of PDE10A inhibitors using fragment-based screening by nanocalorimetry and X-ray crystallography.
J Biomol Screen, 19, 2014
5FJU
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BU of 5fju by Molmil
N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: Q26A M50I G291D F323Y mutant in complex with N-acetyl phenylalanine
分子名称: MAGNESIUM ION, N-acetyl-L-phenylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-13
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.52 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published
4L1L
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BU of 4l1l by Molmil
Rat PKC C2 domain bound to CD
分子名称: CADMIUM ION, Protein kinase C alpha type, SULFATE ION
著者Morales, K.M, Yang, Y, Long, Z, Li, P, Taylor, A.B, Hart, P.J, Igumenova, T.I.
登録日2013-06-03
公開日2013-08-28
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Cd(2+) as a ca(2+) surrogate in protein-membrane interactions: isostructural but not isofunctional.
J.Am.Chem.Soc., 135, 2013
5FJT
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BU of 5fjt by Molmil
N-acyl amino acid racemase from Amycolatopsis sp. Ts-1-60: G291D F323 mutant in complex with N-acetyl phenylalanine
分子名称: MAGNESIUM ION, N-acetyl-L-phenylalanine, O-SUCCINYLBENZOATE SYNTHASE
著者Sanchez Carron, G, Campopiano, D, Grogan, G.
登録日2015-10-12
公開日2016-11-23
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Structure of N-Acylamino Acid Racemase Mutants in Complex with Substrates
To be Published

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