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2WE4
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BU of 2we4 by Molmil
Carbamate kinase from Enterococcus faecalis bound to a sulfate ion and two water molecules, which mimic the substrate carbamyl phosphate
Descriptor: CARBAMATE KINASE 1, SULFATE ION
Authors:Ramon-Maiques, S, Marina, A, Gil-Ortiz, F, Rubio, V.
Deposit date:2009-03-27
Release date:2010-03-16
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.02 Å)
Cite:Substrate Binding and Catalysis in Carbamate Kinase Ascertained by Crystallographic and Site-Directed Mutagenesis Studies. Movements and Significance of a Unique Globular Subdomain of This Key Enzyme for Fermentative ATP Production in Bacteria.
J.Mol.Biol., 397, 2010
3ZFQ
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BU of 3zfq by Molmil
Crystal structure of product-like, processed N-terminal protease Npro with mercury
Descriptor: MERCURY (II) ION, MONOTHIOGLYCEROL, N-TERMINAL PROTEASE NPRO
Authors:Zogg, T, Sponring, M, Schindler, S, Koll, M, Schneider, R, Brandstetter, H, Auer, B.
Deposit date:2012-12-12
Release date:2013-05-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Crystal Structures of the Viral Protease Npro Imply Distinct Roles for the Catalytic Water in Catalysis
Structure, 21, 2013
7D4B
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BU of 7d4b by Molmil
Crystal structure of 4-1BB in complex with a VHH
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ...
Authors:Wang, C.
Deposit date:2020-09-23
Release date:2021-07-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.14 Å)
Cite:Generation of a safe and efficacious llama single-domain antibody fragment (vHH) targeting the membrane-proximal region of 4-1BB for engineering therapeutic bispecific antibodies for cancer.
J Immunother Cancer, 9, 2021
7CZD
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BU of 7czd by Molmil
Crystal structure of PD-L1 in complex with a VHH
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Programmed cell death 1 ligand 1, ...
Authors:Wang, C.
Deposit date:2020-09-08
Release date:2021-07-14
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Generation of a safe and efficacious llama single-domain antibody fragment (vHH) targeting the membrane-proximal region of 4-1BB for engineering therapeutic bispecific antibodies for cancer.
J Immunother Cancer, 9, 2021
7DDM
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BU of 7ddm by Molmil
Crystal Structure of PenA39 beta-Lactamase
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, ACETATE ION, ALA-ALA-ARG-ASP-ALA-ALA-VAL-SER-ASP-ALA-ALA-ALA, ...
Authors:Nukaga, M, Hoshino, T, Papp-Wallace, K.M.
Deposit date:2020-10-29
Release date:2021-11-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Frameshift mutations in genes encoding PBP3 and PBP4 trigger an unusual, extreme beta-lactam resistance phenotype in Burkholderia multivorans
To Be Published
4APX
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BU of 4apx by Molmil
CRYSTAL STRUCTURE OF MOUSE CADHERIN-23 EC1-2 AND PROTOCADHERIN-15 EC1- 2 FORM I
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CADHERIN-23, CALCIUM ION, ...
Authors:Sotomayor, M, Weihofen, W, Gaudet, R, Corey, D.P.
Deposit date:2012-04-07
Release date:2012-11-07
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structure of a Force-Conveying Cadherin Bond Essential for Inner-Ear Mechanotransduction
Nature, 492, 2012
2WE5
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BU of 2we5 by Molmil
Carbamate kinase from Enterococcus faecalis bound to MgADP
Descriptor: ACETATE ION, ADENOSINE-5'-DIPHOSPHATE, CARBAMATE KINASE 1, ...
Authors:Ramon-Maiques, S, Marina, A, Rubio, V.
Deposit date:2009-03-27
Release date:2010-03-16
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:Substrate Binding and Catalysis in Carbamate Kinase Ascertained by Crystallographic and Site- Directed Mutagenesis Studies. Movements and Significance of a Unique Globular Subdomain of This Key Enzyme for Fermentative ATP Production in Bacteria.
J.Mol.Biol., 397, 2010
2W8H
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BU of 2w8h by Molmil
Crystal structure of spin labeled Wza24-345.
Descriptor: CHLORIDE ION, PUTATIVE OUTER MEMBRANE LIPOPROTEIN WZA, S-[(1-oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl] methanesulfonothioate
Authors:Hagelueken, G, Ingledew, W.J, Huang, H, Petrovic-Stojanovska, B, Whitfield, C, ElMkami, H, Schiemann, O, Naismith, J.H.
Deposit date:2009-01-16
Release date:2009-02-10
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.76 Å)
Cite:Peldor Distance Fingerprinting of the Octameric Outer-Membrane Protein Wza from Escherichia Coli.
Angew.Chem.Int.Ed.Engl., 48, 2009
4A2B
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BU of 4a2b by Molmil
Thermotoga maritima FtsA with ATP gamma S
Descriptor: CELL DIVISION PROTEIN FTSA, PUTATIVE, MAGNESIUM ION, ...
Authors:Szwedziak, P, Lowe, J.
Deposit date:2011-09-23
Release date:2012-04-25
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Ftsa Forms Actin-Like Protofilaments
Embo J., 31, 2012
1Y7K
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BU of 1y7k by Molmil
NMR structure family of Human Agouti Signalling Protein (80-132: Q115Y, S124Y)
Descriptor: Agouti Signaling Protein
Authors:McNulty, J.C, Jackson, P.J, Thompson, D.A, Chai, B, Gantz, I, Barsh, G.S, Dawson, P.E, Millhauser, G.L.
Deposit date:2004-12-08
Release date:2005-02-15
Last modified:2021-10-20
Method:SOLUTION NMR
Cite:Structures of the agouti signaling protein.
J.Mol.Biol., 346, 2005
7AMR
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BU of 7amr by Molmil
Crystal structure of the complex of the KFN mutant of Jovi-1 Fab with human TRBC1
Descriptor: CHLORIDE ION, GLYCEROL, Human Jovi-1 Fab fragment, ...
Authors:Ferrari, M, Bulek, A, Bughda, R, Jha, R, Welin, M, Logan, D.T, Sewell, A, Onuoha, S, Pule, M.
Deposit date:2020-10-09
Release date:2022-04-20
Last modified:2022-04-27
Method:X-RAY DIFFRACTION (1.949 Å)
Cite:Structure-Guided Engineering of Immunotherapies Targeting TRBC1 and TRBC2 in T Cell Malignancies
Res Sq, 2022
2VER
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BU of 2ver by Molmil
Structural model for the complex between the Dr adhesins and carcinoembryonic antigen (CEA)
Descriptor: AFIMBRIAL ADHESIN AFA-III, ARCINOEMBRYONIC ANTIGEN-RELATED CELL ADHESION MOLECULE 5, S-[(1-oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-yl)methyl] methanesulfonothioate
Authors:Korotkova, N, Yang, Y, Le Trong, I, Cota, E, Demeler, B, Marchant, J, Thomas, W.E, Stenkamp, R.E, Moseley, S.L, Matthews, S.
Deposit date:2007-10-26
Release date:2008-01-08
Last modified:2011-07-13
Method:SOLUTION NMR
Cite:Binding of Dr Adhesins of Escherichia Coli to Carcinoembryonic Antigen Triggers Receptor Dissociation.
Mol.Microbiol., 67, 2008
7BT8
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BU of 7bt8 by Molmil
Mevo lectin complex with mannotriose
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose, ...
Authors:Sivaji, N, Suguna, K, Surolia, A, Vijayan, M.
Deposit date:2020-03-31
Release date:2021-02-03
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structural and related studies on Mevo lectin from Methanococcus voltae A3: the first thorough characterization of an archeal lectin and its interactions.
Glycobiology, 31, 2021
3ZFR
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BU of 3zfr by Molmil
Crystal structure of product-like, processed N-terminal protease Npro with iridium
Descriptor: HYDROXIDE ION, IRIDIUM (III) ION, MONOTHIOGLYCEROL, ...
Authors:Zogg, T, Sponring, M, Schindler, S, Koll, M, Schneider, R, Brandstetter, H, Auer, B.
Deposit date:2012-12-12
Release date:2013-05-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structures of the Viral Protease Npro Imply Distinct Roles for the Catalytic Water in Catalysis
Structure, 21, 2013
1Y7J
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BU of 1y7j by Molmil
NMR structure family of Human Agouti Signalling Protein (80-132: Q115Y, S124Y)
Descriptor: Agouti Signaling Protein
Authors:McNulty, J.C, Jackson, P.J, Thompson, D.A, Chai, B, Gantz, I, Barsh, G.S, Dawson, P.E, Millhauser, G.L.
Deposit date:2004-12-08
Release date:2005-02-15
Last modified:2021-10-20
Method:SOLUTION NMR
Cite:Structures of the agouti signaling protein.
J.Mol.Biol., 346, 2005
1Q0K
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BU of 1q0k by Molmil
Crystal structure of Ni-containing superoxide dismutase with Ni-ligation corresponding to the thiosulfate-reduced state
Descriptor: NICKEL (II) ION, SULFATE ION, Superoxide dismutase [Ni], ...
Authors:Wuerges, J, Lee, J.-W, Yim, Y.-I, Yim, H.-S, Kang, S.-O, Djinovic Carugo, K.
Deposit date:2003-07-16
Release date:2004-05-18
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structure of nickel-containing superoxide dismutase reveals another type of active site
Proc.Natl.Acad.Sci.USA, 101, 2004
2XE7
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BU of 2xe7 by Molmil
The complete reaction cycle of human phosphoglycerate kinase: The open ternary complex with 3PG and ADP
Descriptor: 3-PHOSPHOGLYCERIC ACID, ADENOSINE-5'-DIPHOSPHATE, PHOSPHOGLYCERATE KINASE 1
Authors:Cliff, M.J, Baxter, N.J, Blackburn, G.M, Merli, A, Vas, M, Waltho, J.P, Bowler, M.W.
Deposit date:2010-05-11
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:A Spring Loaded Release Mechanism Regulates Domain Movement and Catalysis in Phosphoglycerate Kinase.
J.Biol.Chem., 286, 2011
7E4R
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BU of 7e4r by Molmil
Crystal structure of tubulin in complex with D-DM1-SMe
Descriptor: (10E,12E)-86-chloro-14-hydroxy-85,14-dimethoxy-33,2,7,10-tetramethyl-12,6-dioxo-7-aza-1(6,4)-oxazinana-3(2,3)-oxirana-8(1,3)-benzenacyclotetradecaphane-10,12-dien-4-yl N-methyl-N-(3-(methylsulfinothioyl)propanoyl)-D-alaninate, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Wang, Y, Li, W.
Deposit date:2021-02-15
Release date:2021-07-07
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.597 Å)
Cite:C3 ester side chain plays a pivotal role in the antitumor activity of Maytansinoids.
Biochem.Biophys.Res.Commun., 566, 2021
2XE6
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BU of 2xe6 by Molmil
The complete reaction cycle of human phosphoglycerate kinase: The open binary complex with 3PG
Descriptor: 3-PHOSPHOGLYCERIC ACID, PHOSPHOGLYCERATE KINASE 1
Authors:Cliff, M.J, Baxter, N.J, Blackburn, G.M, Merli, A, Vas, M, Waltho, J.P, Bowler, M.W.
Deposit date:2010-05-11
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:A Spring Loaded Release Mechanism Regulates Domain Movement and Catalysis in Phosphoglycerate Kinase.
J.Biol.Chem., 286, 2011
2XE8
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BU of 2xe8 by Molmil
The complete reaction cycle of human phosphoglycerate kinase: The open ternary complex with 3PG and AMP-PNP
Descriptor: 3-PHOSPHOGLYCERIC ACID, PHOSPHOGLYCERATE KINASE 1, PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER
Authors:Cliff, M.J, Baxter, N.J, Blackburn, G.M, Merli, A, Vas, M, Waltho, J.P, Bowler, M.W.
Deposit date:2010-05-11
Release date:2011-01-19
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:A Spring Loaded Release Mechanism Regulates Domain Movement and Catalysis in Phosphoglycerate Kinase.
J.Biol.Chem., 286, 2011
3ZFP
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BU of 3zfp by Molmil
Crystal structure of product-like, processed N-terminal protease Npro with internal His-Tag
Descriptor: CHLORIDE ION, MONOTHIOGLYCEROL, N-TERMINAL PROTEASE NPRO
Authors:Zogg, T, Sponring, M, Schindler, S, Koll, M, Schneider, R, Brandstetter, H, Auer, B.
Deposit date:2012-12-12
Release date:2013-05-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Crystal Structures of the Viral Protease Npro Imply Distinct Roles for the Catalytic Water in Catalysis
Structure, 21, 2013
7D8Q
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BU of 7d8q by Molmil
The structure of nucleotide phosphatase Sa1684 complex with GDP analogue from Staphylococcus aureus
Descriptor: MAGNESIUM ION, UPF0374 protein SAB1800c, [(2R,3R,4S,5S)-5-(2-azanyl-6-oxidanyl-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl bis(oxidanyl)phosphinothioyl hydrogen phosphate
Authors:Wang, Z, Li, X.
Deposit date:2020-10-09
Release date:2021-03-17
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:The structural mechanism for the nucleoside tri- and diphosphate hydrolysis activity of Ntdp from Staphylococcus aureus.
Febs J., 288, 2021
3ZFT
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BU of 3zft by Molmil
Crystal structure of product-like, processed N-terminal protease Npro at pH 3
Descriptor: CHLORIDE ION, MONOTHIOGLYCEROL, N-TERMINAL PROTEASE NPRO
Authors:Zogg, T, Sponring, M, Schindler, S, Koll, M, Schneider, R, Brandstetter, H, Auer, B.
Deposit date:2012-12-12
Release date:2013-05-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structures of the Viral Protease Npro Imply Distinct Roles for the Catalytic Water in Catalysis
Structure, 21, 2013
2V1Q
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BU of 2v1q by Molmil
Atomic-resolution structure of the yeast Sla1 SH3 domain 3
Descriptor: CHLORIDE ION, CYTOSKELETON ASSEMBLY CONTROL PROTEIN SLA1, PLATINUM (II) ION, ...
Authors:Kursula, I, Kursula, P, Zou, P, Lehmann, F, Song, Y.H, Wilmanns, M.
Deposit date:2007-05-29
Release date:2008-06-03
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Structural Genomics of Yeast SH3 Domains
To be Published
7E48
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BU of 7e48 by Molmil
Crystal structure of InhA in complex with 3-nitropropanoic acid inhibitor
Descriptor: 3-NITROPROPANOIC ACID, Enoyl-[acyl-carrier-protein] reductase [NADH], GLYCEROL, ...
Authors:Songsiriritthigul, C, Hanwarinroj, C, Suttipanta, N, Kamsri, P, Kittakoop, P, Pungpo, P.
Deposit date:2021-02-10
Release date:2021-11-24
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Inhibition of Mycobacterium tuberculosis InhA by 3-nitropropanoic acid.
Proteins, 90, 2022

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