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8VI8
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BU of 8vi8 by Molmil
Engineered glutamine binding protein and a cobaloxime ligand - no GLN bound
Descriptor: AZIDOBIS (DIMETHYLGLYOXIMATO) PYRIDINECOBALT, Amino acid ABC transporter substrate-binding protein, SODIUM ION, ...
Authors:Boggs, D.G, Fatima, S, Olshansky, L, Bridwell-Rabb, J.
Deposit date:2024-01-03
Release date:2024-09-04
Method:X-RAY DIFFRACTION (3.21 Å)
Cite:Conformation-Dependent Hydrogen-Bonding Interactions in a Switchable Artificial Metalloprotein.
Biochemistry, 63, 2024
1LG6
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BU of 1lg6 by Molmil
Crystal Structure Analysis of HCA II Mutant T199P in Complex with Thiocyanate
Descriptor: Carbonic anhydrase II, THIOCYANATE ION, ZINC ION
Authors:Huang, S, Sjoblom, B, Sauer-Eriksson, A.E, Jonsson, B.-H.
Deposit date:2002-04-15
Release date:2002-07-24
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Organization of an efficient carbonic anhydrase: implications for the mechanism based on structure-function studies of a T199P/C206S mutant.
Biochemistry, 41, 2002
1OAZ
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BU of 1oaz by Molmil
IgE Fv SPE7 complexed with a recombinant thioredoxin
Descriptor: IMMUNOGLOBULIN E, THIOREDOXIN 1
Authors:James, L.C, Roversi, P, Tawfik, D.
Deposit date:2003-01-21
Release date:2004-01-15
Last modified:2013-10-30
Method:X-RAY DIFFRACTION (2.78 Å)
Cite:Antibody Multispecificity Mediated by Conformational Diversity
Science, 299, 2003
4KL7
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BU of 4kl7 by Molmil
Crystal structure of the catalytic domain of RpfB from Mycobacterium tuberculosis
Descriptor: Resuscitation-promoting factor RpfB, SULFATE ION
Authors:Squeglia, F, Romano, M, Ruggiero, A, Berisio, R.
Deposit date:2013-05-07
Release date:2013-06-26
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Carbohydrate Recognition by RpfB from Mycobacterium tuberculosis Unveiled by Crystallographic and Molecular Dynamics Analyses.
Biophys.J., 104, 2013
2MUL
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BU of 2mul by Molmil
Solution Structure of the UBM1 domain of human HUWE1/ARF-BP1
Descriptor: E3 ubiquitin-protein ligase HUWE1
Authors:Farhadi, S, Khatun, R, Lemak, A, Kaustov, L, Ramabadran, R, Hunter, H, Sheng, Y.
Deposit date:2014-09-12
Release date:2015-09-16
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Solution structure of Ubiquitin Binding Motif of human Arf-bp1
To be Published
1OAX
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BU of 1oax by Molmil
Fv Structure of the IgE SPE-7 in complex with acenaphthenequinone
Descriptor: ACENAPHTHENEQUINONE, IMMUNOGLOBULIN E
Authors:James, L.C, Roversi, P, Tawfik, D.
Deposit date:2003-01-21
Release date:2004-01-15
Last modified:2013-10-30
Method:X-RAY DIFFRACTION (2.67 Å)
Cite:Antibody Multispecificity Mediated by Conformational Diversity
Science, 299, 2003
1PPI
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BU of 1ppi by Molmil
THE ACTIVE CENTER OF A MAMMALIAN ALPHA-AMYLASE. THE STRUCTURE OF THE COMPLEX OF A PANCREATIC ALPHA-AMYLASE WITH A CARBOHYDRATE INHIBITOR REFINED TO 2.2 ANGSTROMS RESOLUTION
Descriptor: 4,6-dideoxy-4-{[(1S,5R,6S)-3-formyl-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl]amino}-alpha-D-xylo-hex-5-enopyranose-(1-4)-beta-D-glucopyranose, ALPHA-AMYLASE, CALCIUM ION, ...
Authors:Qian, M, Haser, R, Payan, F.
Deposit date:1994-02-22
Release date:1995-05-24
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:The active center of a mammalian alpha-amylase. Structure of the complex of a pancreatic alpha-amylase with a carbohydrate inhibitor refined to 2.2-A resolution.
Biochemistry, 33, 1994
2GAZ
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BU of 2gaz by Molmil
Mycobacterial lipoglycan presentation by CD1d
Descriptor: (2R)-3-[(HYDROXY{[(2R,3R,5S,6R)-3,4,5-TRIHYDROXY-2,6-BIS(ALPHA-D-MANNOPYRANOSYLOXY)CYCLOHEXYL]OXY}PHOSPHORYL)OXY]PROPAN E-1,2-DIYL DIHEXADECANOATE, 2-acetamido-2-deoxy-beta-D-glucopyranose, T-cell surface glycoprotein CD1d1, ...
Authors:Zajonc, D.M.
Deposit date:2006-03-09
Release date:2006-09-26
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Structural characterization of mycobacterial phosphatidylinositol mannoside binding to mouse CD1d.
J.Immunol., 177, 2006
6BRY
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BU of 6bry by Molmil
Tubulin-RB3_SLD-TTL in complex with heterocyclic pyrimidine compound 6a
Descriptor: 1-(2-chlorofuro[3,2-d]pyrimidin-4-yl)-6-methoxy-1,2,3,4-tetrahydroquinoline, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Kumar, G, Wang, Y, Li, W, White, S.W.
Deposit date:2017-12-01
Release date:2018-06-27
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Heterocyclic-Fused Pyrimidines as Novel Tubulin Polymerization Inhibitors Targeting the Colchicine Binding Site: Structural Basis and Antitumor Efficacy.
J. Med. Chem., 61, 2018
1OAR
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BU of 1oar by Molmil
Fv IgE SPE-7 in complex with Alizarin Red
Descriptor: 1,2-ETHANEDIOL, ALIZARIN RED, CACODYLATE ION, ...
Authors:James, L.C, Roversi, P, Tawfik, D.
Deposit date:2003-01-21
Release date:2004-01-15
Last modified:2013-10-30
Method:X-RAY DIFFRACTION (2.23 Å)
Cite:Antibody Multispecificity Mediated by Conformational Diversity
Science, 299, 2003
1C5C
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BU of 1c5c by Molmil
DECARBOXYLASE CATALYTIC ANTIBODY 21D8-HAPTEN COMPLEX
Descriptor: 2-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACID, CHIMERIC DECARBOXYLASE ANTIBODY 21D8, GLYCEROL
Authors:Hotta, K, Wilson, I.A.
Deposit date:1999-11-09
Release date:2000-10-11
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Catalysis of decarboxylation by a preorganized heterogeneous microenvironment: crystal structures of abzyme 21D8.
J.Mol.Biol., 302, 2000
2ZK7
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BU of 2zk7 by Molmil
Structure of a C-terminal deletion mutant of Thermoplasma acidophilum aldohexose dehydrogenase (AldT)
Descriptor: Glucose 1-dehydrogenase related protein
Authors:Nishioka, T, Yasutake, Y, Nishiya, Y, Tamura, N, Tamura, T.
Deposit date:2008-03-12
Release date:2009-01-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:C-terminal tail derived from the neighboring subunit is critical for the activity of Thermoplasma acidophilum D-aldohexose dehydrogenase
Proteins, 74, 2009
6W69
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BU of 6w69 by Molmil
The structure of F64, S172A Keap1-BTB domain
Descriptor: Kelch-like ECH-associated protein 1
Authors:Mena, E.L, Gee, C.L, Kuriyan, J, Rape, M.
Deposit date:2020-03-16
Release date:2020-08-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.501 Å)
Cite:Structural basis for dimerization quality control.
Nature, 586, 2020
5Z4P
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BU of 5z4p by Molmil
Crystal structure of tubulin-stathmin-TTL-Compound TCA complex
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 6,7,8-trimethoxy-1-(4-methoxyphenyl)-4,5-dihydro-2~{H}-benzo[e]indazole, CALCIUM ION, ...
Authors:Zhang, H, Luo, C.
Deposit date:2018-01-12
Release date:2019-01-16
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Discovery and Design of novel Tubulin inhibitors
To Be Published
2QM4
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BU of 2qm4 by Molmil
Crystal structure of human XLF/Cernunnos, a non-homologous end-joining factor
Descriptor: Non-homologous end-joining factor 1
Authors:Li, Y, Chirgadze, D.Y, Sibanda, B.L, Bolanos-Garcia, V.M, Davies, O.R, Blundell, T.L.
Deposit date:2007-07-14
Release date:2007-12-11
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structure of human XLF/Cernunnos reveals unexpected differences from XRCC4 with implications for NHEJ.
Embo J., 27, 2008
1RGN
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BU of 1rgn by Molmil
Structure of the reaction centre from Rhodobacter sphaeroides carotenoidless strain R-26.1 reconstituted with spheroidene
Descriptor: BACTERIOCHLOROPHYLL A, BACTERIOPHEOPHYTIN A, FE (III) ION, ...
Authors:Roszak, A.W, Frank, H.A, McKendrick, K, Mitchell, I.A, Cogdell, R.J, Isaacs, N.W.
Deposit date:2003-11-12
Release date:2004-04-27
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Protein Regulation of Carotenoid Binding: Gatekeeper and Locking Amino Acid Residues in Reaction Centers of Rhodobacter sphaeroides
STRUCTURE, 12, 2004
1RG5
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BU of 1rg5 by Molmil
Structure of the photosynthetic reaction centre from Rhodobacter sphaeroides carotenoidless strain R-26.1
Descriptor: BACTERIOCHLOROPHYLL A, BACTERIOPHEOPHYTIN A, CARDIOLIPIN, ...
Authors:Roszak, A.W, Hashimoto, H, Gardiner, A.T, Cogdell, R.J, Isaacs, N.W.
Deposit date:2003-11-11
Release date:2004-04-27
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Protein Regulation of Carotenoid Binding: Gatekeeper and Locking Amino Acid Residues in Reaction Centers of Rhodobacter sphaeroides
STRUCTURE, 12, 2004
4GA2
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BU of 4ga2 by Molmil
Structure of the N-terminal domain of Nup358
Descriptor: E3 SUMO-PROTEIN LIGASE RANBP2
Authors:Kassube, S.A, Lin, D.H, Stuwe, T, Hoelz, A.
Deposit date:2012-07-24
Release date:2012-09-26
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (0.95 Å)
Cite:Crystal structure of the N-terminal domain of Nup358/RanBP2.
J.Mol.Biol., 423, 2012
6W68
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BU of 6w68 by Molmil
The structure of V98A S172A Keap1-BTB domain
Descriptor: Kelch-like ECH-associated protein 1
Authors:Mena, E.L, Gee, C.L, Kuriyan, J, Rape, M.
Deposit date:2020-03-16
Release date:2020-08-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Structural basis for dimerization quality control.
Nature, 586, 2020
1NEL
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BU of 1nel by Molmil
FLUORIDE INHIBITION OF YEAST ENOLASE: CRYSTAL STRUCTURE OF THE ENOLASE-MG2+-F--PI COMPLEX AT 2.6-ANGSTROMS RESOLUTION
Descriptor: ENOLASE, FLUORIDE ION, MAGNESIUM ION, ...
Authors:Lebioda, L, Zhang, E, Lewinski, K, Brewer, M.J.
Deposit date:1993-08-20
Release date:1994-01-31
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Fluoride inhibition of yeast enolase: crystal structure of the enolase-Mg(2+)-F(-)-Pi complex at 2.6 A resolution.
Proteins, 16, 1993
6J1C
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BU of 6j1c by Molmil
Photoswitchable fluorescent protein Gamillus, N150C/T204V double mutant, off-state
Descriptor: CHLORIDE ION, GLYCEROL, Green fluorescent protein
Authors:Nakashima, R, Shinoda, H, Matsuda, T, Nagai, T.
Deposit date:2018-12-28
Release date:2019-11-06
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Acid-Tolerant Reversibly Switchable Green Fluorescent Protein for Super-resolution Imaging under Acidic Conditions.
Cell Chem Biol, 26, 2019
6W67
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BU of 6w67 by Molmil
The structure of S172A Keap1-BTB domain
Descriptor: Kelch-like ECH-associated protein 1
Authors:Mena, E.L, Gee, C.L, Kuriyan, J, Rape, M.
Deposit date:2020-03-16
Release date:2020-08-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural basis for dimerization quality control.
Nature, 586, 2020
8OWZ
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BU of 8owz by Molmil
Crystal structure of human Sirt2 in complex with a triazole-based SirReal
Descriptor: (R,R)-2,3-BUTANEDIOL, 1,2-ETHANEDIOL, 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[5-[[3-[[1-(2-methoxyethyl)-1,2,3-triazol-4-yl]methoxy]phenyl]methyl]-1,3-thiazol-2-yl]ethanamide, ...
Authors:Friedrich, F, Zhang, L, Schiedel, M, Einsle, O, Jung, M.
Deposit date:2023-04-28
Release date:2023-11-15
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Development of First-in-Class Dual Sirt2/HDAC6 Inhibitors as Molecular Tools for Dual Inhibition of Tubulin Deacetylation.
J.Med.Chem., 66, 2023
1NIG
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BU of 1nig by Molmil
2.0 A Structure of Protein of Unknown Function from Thermoplasma acidophilum
Descriptor: hypothetical protein TA1238
Authors:Sanishvili, R, Edwards, A, Christendat, D, Midwest Center for Structural Genomics (MCSG)
Deposit date:2002-12-23
Release date:2003-07-15
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of the hypothetical protein TA1238 from Thermoplasma acidophilum: a new type of helical super-bundle.
J.STRUCT.FUNCT.GENOM., 5, 2004
2JTT
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BU of 2jtt by Molmil
Solution structure of calcium loaded S100A6 bound to C-terminal Siah-1 interacting protein
Descriptor: Calcyclin-binding protein, Protein S100-A6
Authors:Lee, Y, Chazin, W.J.
Deposit date:2007-08-06
Release date:2008-08-19
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Structure of the S100A6 complex with a fragment from the C-terminal domain of Siah-1 interacting protein: a novel mode for S100 protein target recognition.
Biochemistry, 47, 2008

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