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3VDZ
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BU of 3vdz by Molmil
Tailoring Encodable Lanthanide-Binding Tags as MRI Contrast Agents: xq-dSE3-Ubiquitin at 2.4 Angstroms
Descriptor: GADOLINIUM ATOM, SULFATE ION, Ubiquitin-40S ribosomal protein S27a
Authors:Daughtry, K.D, Martin, L.J, Surraju, A, Imperiali, B, Allen, K.N.
Deposit date:2012-01-06
Release date:2012-11-28
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Tailoring encodable lanthanide-binding tags as MRI contrast agents.
Chembiochem, 13, 2012
4PYX
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BU of 4pyx by Molmil
Crystal structure of human carbonic anhydrase isozyme II with inhibitor
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-(cyclooctylamino)-3,5,6-trifluoro-4-[(2-hydroxyethyl)sulfanyl]benzenesulfonamide, Carbonic anhydrase 2, ...
Authors:Smirnov, A, Manakova, E, Grazulis, S.
Deposit date:2014-03-28
Release date:2015-01-28
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Discovery and characterization of novel selective inhibitors of carbonic anhydrase IX.
J.Med.Chem., 57, 2014
3VVV
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BU of 3vvv by Molmil
Skich domain of NDP52
Descriptor: Calcium-binding and coiled-coil domain-containing protein 2
Authors:Akutsu, M, Muhlinen, N.V, Randow, F, Komander, D.
Deposit date:2012-07-28
Release date:2013-02-27
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:LC3C, bound selectively by a noncanonical LIR motif in NDP52, is required for antibacterial autophagy
Mol.Cell, 48, 2012
3VVY
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BU of 3vvy by Molmil
Crystal Strucuture of The Ethidium-Bound Form of RamR (Transcriptional Regurator of TetR Family) from Salmonella Typhimurium
Descriptor: ETHIDIUM, Putative regulatory protein
Authors:Sakurai, K, Nikaido, E, Nakashima, R, Yamasaki, S, Yamaguchi, A, Nishino, K.
Deposit date:2012-07-30
Release date:2013-07-03
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:The crystal structure of multidrug-resistance regulator RamR with multiple drugs
Nat Commun, 4, 2013
3VWD
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BU of 3vwd by Molmil
Crystal structure of alpha-tubulin acetyltransferase domain of human Mec-17 in complex with acetoacetyl-CoA (P21212 form)
Descriptor: 1,2-ETHANEDIOL, ACETYL COENZYME *A, Alpha-tubulin N-acetyltransferase, ...
Authors:Yuzawa, S, Sumimoto, H.
Deposit date:2012-08-22
Release date:2013-08-28
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Crystal structure of alpha-tubulin acetyltransferase domain of human Mec-17
To be Published
3VFO
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BU of 3vfo by Molmil
crystal structure of HLA B*3508 LPEP157A, HLA mutant Ala157
Descriptor: Beta-2-microglobulin, LPEP peptide from EBV, LPEPLPQGQLTAY, ...
Authors:Liu, Y.C, Rossjohn, J, Gras, S.
Deposit date:2012-01-10
Release date:2012-03-07
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The Energetic Basis Underpinning T-cell Receptor Recognition of a Super-bulged Peptide Bound to a Major Histocompatibility Complex Class I Molecule.
J.Biol.Chem., 287, 2012
3VX8
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BU of 3vx8 by Molmil
Crystal structure of Arabidopsis thaliana Atg7NTD-Atg3 complex
Descriptor: Autophagy-related protein 3, Ubiquitin-like modifier-activating enzyme atg7
Authors:Matoba, K, Fujioka, Y, Noda, N.N.
Deposit date:2012-09-11
Release date:2012-11-14
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.11 Å)
Cite:Noncanonical recognition and UBL loading of distinct E2s by autophagy-essential Atg7.
Nat.Struct.Mol.Biol., 19, 2012
4Q0N
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BU of 4q0n by Molmil
Crystal Structure of the fifth bromodomain of Human Poly-bromodomain containing protein 1 (PB1) in complex with a hydroxyphenyl-propenone ligand
Descriptor: (2E)-1-(2-hydroxyphenyl)-3-(2,4,5,7-tetrahydro-6H-pyrazolo[3,4-c]pyridin-6-yl)prop-2-en-1-one, 1,2-ETHANEDIOL, Protein polybromo-1
Authors:Filippakopoulos, P, Picaud, S, Felletar, I, Martin, S, Monteiro, O, Fedorov, O, Chaikuad, A, Yue, W, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2014-04-02
Release date:2014-05-07
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Crystal Structure of the fifth bromodomain of Human Poly-bromodomain containing protein 1 (PB1) in complex with a hydroxyphenyl-propenone ligand
To be Published
4PX8
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BU of 4px8 by Molmil
Structure of P. vulgaris HigB toxin
Descriptor: CHLORIDE ION, Killer protein
Authors:Schureck, M.A, Dunkle, J.A, Maehigashi, T, Dunham, C.M.
Deposit date:2014-03-22
Release date:2015-10-21
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Defining the mRNA recognition signature of a bacterial toxin protein.
Proc.Natl.Acad.Sci.USA, 112, 2015
4PZ4
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BU of 4pz4 by Molmil
High-resolution crystal structure of the human CD44 hyaluronan binding domain in new space group
Descriptor: 1,2-ETHANEDIOL, CD44 antigen, DI(HYDROXYETHYL)ETHER, ...
Authors:Liu, L.K, Finzel, B.
Deposit date:2014-03-28
Release date:2014-09-17
Last modified:2014-10-15
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:High-resolution crystal structures of alternate forms of the human CD44 hyaluronan-binding domain reveal a site for protein interaction.
Acta Crystallogr F Struct Biol Commun, 70, 2014
3VB2
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BU of 3vb2 by Molmil
Crystal Structure of the Reduced Form of MarR from E.coli
Descriptor: Multiple antibiotic resistance protein marR
Authors:Lou, H, Zhu, R, Hao, Z.
Deposit date:2011-12-30
Release date:2013-01-30
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:The reduced form of MarR structure
To be Published
4Q12
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BU of 4q12 by Molmil
Crystal structure of a putative uncharacterized protein Rv3404c and likely sugar N-formyltransferase from Mycobacterium tuberculosis bound to uridine diphosphate
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, URIDINE-5'-DIPHOSPHATE, ...
Authors:Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2014-04-02
Release date:2014-04-23
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Crystal structure of a putative uncharacterized protein Rv3404c and likely sugar N-formyltransferase from Mycobacterium tuberculosis
To be Published
4Q2Q
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BU of 4q2q by Molmil
ZO1 PDZ3 in Complex with a Phage-Derived Peptide
Descriptor: Tight junction protein ZO-1
Authors:Appleton, B.A, Wiesmann, C.
Deposit date:2014-04-09
Release date:2014-09-10
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:A structural portrait of the PDZ domain family.
J.Mol.Biol., 426, 2014
4M0H
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BU of 4m0h by Molmil
Crystal structure of a putative anti-sigma factor (BDI_1681) from Parabacteroides distasonis ATCC 8503 at 2.50 A resolution
Descriptor: CHLORIDE ION, Conserved hypothetical protein, putative anti-sigma factor, ...
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2013-08-01
Release date:2013-10-16
Last modified:2023-02-01
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of a conserved hypothetical protein, putative anti-sigma factor (BDI_1681) from Parabacteroides distasonis ATCC 8503 at 2.50 A resolution
To be published
3VV6
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BU of 3vv6 by Molmil
Crystal Structure of beta secetase in complex with 2-amino-3-methyl-6-((1S, 2R)-2-phenylcyclopropyl)pyrimidin-4(3H)-one
Descriptor: 2-amino-3-methyl-6-[(1S,2R)-2-phenylcyclopropyl]pyrimidin-4(3H)-one, Beta-secretase 1, GLYCEROL, ...
Authors:Yonezawa, S, Yamamoto, T, Yamakawa, H, Muto, C, Hosono, M, Hattori, K, Higashino, K, Sakagami, M, Togame, H, Tanaka, Y, Nakano, T, Takemoto, H, Arisawa, M, Shuto, S.
Deposit date:2012-07-17
Release date:2012-10-24
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Conformational restriction approach to beta-secretase (BACE1) inhibitors: effect of a cyclopropane ring to induce an alternative binding mode
J.Med.Chem., 55, 2012
4M0N
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BU of 4m0n by Molmil
Crystal structure of a putative anti-sigma factor (BDI_1681) from Parabacteroides distasonis ATCC 8503 at 1.65 A resolution
Descriptor: 1,2-ETHANEDIOL, Conserved hypothetical protein, putative anti-sigma factor, ...
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2013-08-01
Release date:2013-10-16
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Crystal structure of a conserved hypothetical protein, putative anti-sigma factor (BDI_1681) from Parabacteroides distasonis ATCC 8503 at 1.65 A resolution
To be published
3VVX
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BU of 3vvx by Molmil
Crystal Strucuture of RamR (Transcriptional Regurator of TetR Family) from Salmonella Typhimurium
Descriptor: Putative regulatory protein, SULFATE ION
Authors:Sakurai, K, Nikaido, E, Nakashima, R, Yamasaki, S, Yamaguchi, A, Nishino, K.
Deposit date:2012-07-30
Release date:2013-07-03
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:The crystal structure of multidrug-resistance regulator RamR with multiple drugs
Nat Commun, 4, 2013
3VFL
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BU of 3vfl by Molmil
Structure, Function, Stability and Knockout Phenotype of Dihydrodipicolinate Synthase from Streptococcus pneumoniae
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Dihydrodipicolinate synthase, GLYCEROL, ...
Authors:Gorman, M.A.
Deposit date:2012-01-10
Release date:2013-06-12
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Structure, Function, Stability and Knockout Phenotype of Dihydrodipicolinate Synthase from Streptococcus pneumoniae
To be Published
4Q78
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BU of 4q78 by Molmil
Structure-assisted design of carborane-based inhibitors of carbonic anhydrase
Descriptor: 1-(sulfamoylamino)methyl-1,2-dicarba-closo-dodecaborane, Carbonic anhydrase 2, MERCURIBENZOIC ACID, ...
Authors:Mader, P, Brynda, J, Rezacova, P.
Deposit date:2014-04-24
Release date:2015-03-18
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1 Å)
Cite:Carborane-based carbonic anhydrase inhibitors: insight into CAII/CAIX specificity from a high-resolution crystal structure, modeling, and quantum chemical calculations.
Biomed Res Int, 2014, 2014
3VKS
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BU of 3vks by Molmil
Assimilatory nitrite reductase (Nii3) - NO complex from tobbaco leaf
Descriptor: CHLORIDE ION, IRON/SULFUR CLUSTER, NITRIC OXIDE, ...
Authors:Nakano, S, Takahashi, M, Sakamoto, A, Morikawa, H, Katayanagi, K.
Deposit date:2011-11-20
Release date:2012-04-25
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:The reductive reaction mechanism of tobacco nitrite reductase derived from a combination of crystal structures and ultraviolet-visible microspectroscopy
Proteins, 80, 2012
3VLY
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BU of 3vly by Molmil
Assimilatory nitrite reductase (Nii3) - N226K mutant - SO3 partial complex from tobacco leaf
Descriptor: CHLORIDE ION, IRON/SULFUR CLUSTER, Nitrite reductase, ...
Authors:Nakano, S, Takahashi, M, Sakamoto, A, Morikawa, H, Katayanagi, K.
Deposit date:2011-12-05
Release date:2012-09-26
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:X-ray crystal structure of a mutant assimilatory nitrite reductase that shows sulfite reductase-like activity
Chem.Biodivers., 9, 2012
3VNO
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BU of 3vno by Molmil
Cytochrome P450SP alpha (CYP152B1) mutant R241E
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Fatty acid alpha-hydroxylase, PROTOPORPHYRIN IX CONTAINING FE
Authors:Fujishiro, T, Shoji, O, Sugimoto, H, Shiro, Y, Watanabe, Y.
Deposit date:2012-01-17
Release date:2013-02-06
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:A substrate-binding-state mimic of H2O2-dependent cytochrome P450 produced by one-point mutagenesis and peroxygenation of non-native substrates
Catalysis Science And Technology, 6, 2016
3VDX
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BU of 3vdx by Molmil
Structure of a 16 nm protein cage designed by fusing symmetric oligomeric domains
Descriptor: Designed 16nm tetrahedral protein cage containing Non-haem bromoperoxidase BPO-A2 and Matrix protein 1
Authors:Lai, Y.-T, Cascio, D, Yeates, T.O.
Deposit date:2012-01-06
Release date:2012-06-20
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (3.002 Å)
Cite:Structure of a 16-nm cage designed by using protein oligomers.
Science, 336, 2012
4MFR
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BU of 4mfr by Molmil
Crystal structure of Mycobacterium tuberculosis CarD
Descriptor: GLYCEROL, IODIDE ION, RNA polymerase-binding transcription factor CarD, ...
Authors:Kaur, G, Thakur, K.G.
Deposit date:2013-08-28
Release date:2013-11-06
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of Mycobacterium tuberculosis CarD, an essential RNA polymerase binding protein, reveals a quasidomain-swapped dimeric structural architecture.
Proteins, 82, 2014
4Q5K
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BU of 4q5k by Molmil
Crystal structure of a N-acetylmuramoyl-L-alanine amidase (BACUNI_02947) from Bacteroides uniformis ATCC 8492 at 1.30 A resolution
Descriptor: (2R)-2-[[(1R,2S,3R,4R,5R)-4-acetamido-2-[(2S,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy]propanoic acid, SODIUM ION, Uncharacterized protein
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2014-04-17
Release date:2014-05-21
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Structure-guided functional characterization of DUF1460 reveals a highly specific NlpC/P60 amidase family.
Structure, 22, 2014

222415

数据于2024-07-10公开中

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