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8JJK
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BU of 8jjk by Molmil
SP1746 in complex with ADP
Descriptor: ADENOSINE-5'-DIPHOSPHATE, FE (III) ION, GLYCEROL, ...
Authors:Jin, Y, Niu, L, Ke, J.
Deposit date:2023-05-30
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JKP
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BU of 8jkp by Molmil
SP1746 in complex with dTMP
Descriptor: FE (III) ION, GLYCEROL, SULFATE ION, ...
Authors:Jin, Y, Ke, J, Niu, L.
Deposit date:2023-06-01
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JKR
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BU of 8jkr by Molmil
SP1746 in complex with UMP
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, GLYCEROL, ...
Authors:Jin, Y, Niu, L, Ke, J.
Deposit date:2023-06-01
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JK5
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BU of 8jk5 by Molmil
Crystal structure of SP1746 from Streptococcus pneumoniae serotype 4 (strain ATCC BAA-334 / TIGR4)
Descriptor: FE (III) ION, GLYCEROL, SULFATE ION, ...
Authors:Jin, Y, Niu, L, Ke, J.
Deposit date:2023-05-31
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JK9
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BU of 8jk9 by Molmil
SP1746 in complex with GDP
Descriptor: FE (III) ION, GLYCEROL, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Jin, Y, Ke, J, Niu, L.
Deposit date:2023-06-01
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JJA
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BU of 8jja by Molmil
SP1746 in complex with acetate ions
Descriptor: ACETATE ION, FE (III) ION, bis(5'-nucleosyl)-tetraphosphatase (symmetrical)
Authors:Jin, Y, Niu, L, Ke, J.
Deposit date:2023-05-30
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
8JK8
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BU of 8jk8 by Molmil
SP1746 in complex with UDP
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, GLYCEROL, ...
Authors:Jin, Y, Niu, L, Ke, J.
Deposit date:2023-06-01
Release date:2024-05-08
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural and biochemical characterization of a nucleotide hydrolase from Streptococcus pneumonia.
Structure, 2024
6IEX
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BU of 6iex by Molmil
Crystal structure of HLA-B*4001 in complex with SARS-CoV derived peptide N216-225 GETALALLLL
Descriptor: Beta-2-microglobulin, GLY-GLU-THR-ALA-LEU-ALA-LEU-LEU-LEU-LEU, MHC class I antigen
Authors:Ji, W, Niu, L, Peng, W, Zhang, Y, Shi, Y, Qi, J, Gao, G.F, Liu, W.J.
Deposit date:2018-09-17
Release date:2019-09-18
Last modified:2021-03-31
Method:X-RAY DIFFRACTION (2.314 Å)
Cite:Salt bridge-forming residues positioned over viral peptides presented by MHC class I impacts T-cell recognition in a binding-dependent manner.
Mol.Immunol., 112, 2019
4HG5
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BU of 4hg5 by Molmil
Structural insights into yeast Nit2: wild-type yeast Nit2 in complex with oxaloacetate
Descriptor: CACODYLATE ION, GLYCEROL, OXALOACETATE ION, ...
Authors:Liu, H, Qiu, X, Zhang, M, Gao, Y, Niu, L, Teng, M.
Deposit date:2012-10-07
Release date:2013-07-31
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Structures of enzyme-intermediate complexes of yeast Nit2: insights into its catalytic mechanism and different substrate specificity compared with mammalian Nit2
Acta Crystallogr.,Sect.D, 69, 2013
4HGD
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BU of 4hgd by Molmil
Structural insights into yeast Nit2: C169S mutant of yeast Nit2 in complex with an endogenous peptide-like ligand
Descriptor: CACODYLATE ION, GLYCEROL, N-(4-carboxy-4-oxobutanoyl)-L-cysteinylglycine, ...
Authors:Liu, H, Qiu, X, Zhang, M, Gao, Y, Niu, L, Teng, M.
Deposit date:2012-10-08
Release date:2013-07-31
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Structures of enzyme-intermediate complexes of yeast Nit2: insights into its catalytic mechanism and different substrate specificity compared with mammalian Nit2
Acta Crystallogr.,Sect.D, 69, 2013
4HG3
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BU of 4hg3 by Molmil
Structural insights into yeast Nit2: wild-type yeast Nit2 in complex with alpha-ketoglutarate
Descriptor: 2-OXOGLUTARIC ACID, CACODYLATE ION, GLYCEROL, ...
Authors:Liu, H, Qiu, X, Zhang, M, Gao, Y, Niu, L, Teng, M.
Deposit date:2012-10-06
Release date:2013-07-31
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Structures of enzyme-intermediate complexes of yeast Nit2: insights into its catalytic mechanism and different substrate specificity compared with mammalian Nit2
Acta Crystallogr.,Sect.D, 69, 2013
4H0S
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BU of 4h0s by Molmil
Crystal structure analysis of a basic phospholipase A2 from Trimeresurus stejnegeri venom
Descriptor: Basic phospholipase A2 homolog CTs-R6, SODIUM ION
Authors:Zeng, F, Niu, L, Li, X, Teng, M.
Deposit date:2012-09-10
Release date:2012-09-19
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Crystal structure analysis of a basic phospholipase A2 from Trimeresurus stejnegeri venom
To be Published
4H5U
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BU of 4h5u by Molmil
Structural insights into yeast Nit2: wild-type yeast Nit2
Descriptor: CACODYLATE ION, GLYCEROL, Probable hydrolase NIT2
Authors:Liu, H, Qiu, X, Zhang, M, Gao, Y, Niu, L, Teng, M.
Deposit date:2012-09-18
Release date:2013-07-31
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:Structures of enzyme-intermediate complexes of yeast Nit2: insights into its catalytic mechanism and different substrate specificity compared with mammalian Nit2
Acta Crystallogr.,Sect.D, 69, 2013
4HG9
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BU of 4hg9 by Molmil
Crystal structure of AhV_bPA, a basic PLA2 from Agkistrodon halys pallas venom
Descriptor: Basic phospholipase A2 B, CALCIUM ION, CITRIC ACID, ...
Authors:Zeng, F, Niu, L, Li, X, Teng, M.
Deposit date:2012-10-07
Release date:2012-10-17
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structure of AhV_bPA, a basic PLA2 from Agkistrodon halys pallas venom
TO BE PUBLISHED
4KEG
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BU of 4keg by Molmil
Crystal Structure of MBP Fused Human SPLUNC1
Descriptor: MAGNESIUM ION, Maltose-binding periplasmic/Palate lung and nasal epithelium clone fusion protein, octyl beta-D-glucopyranoside
Authors:Ning, F, Wang, C, Niu, L, Chu, H.W, Zhang, G.
Deposit date:2013-04-25
Release date:2014-04-30
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The Lipid Ligands of the SPLUNC1 Protein
To be Published
5XLT
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BU of 5xlt by Molmil
The crystal structure of tubulin in complex with 4'-demethylepipodophyllotoxin
Descriptor: (5S,5aR,8aR,9R)-9-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-oxidanyl-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Yu, Y, Chen, Q.
Deposit date:2017-05-11
Release date:2017-09-27
Last modified:2024-03-27
Method:X-RAY DIFFRACTION (2.813 Å)
Cite:Structure of 4'-demethylepipodophyllotoxin in complex with tubulin provides a rationale for drug design
Biochem. Biophys. Res. Commun., 493, 2017
6KNZ
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BU of 6knz by Molmil
Crystal structure of T2R-TTL-KXO1 complex
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 2-[5-[4-(2-morpholin-4-ylethoxy)phenyl]pyridin-2-yl]-~{N}-(phenylmethyl)ethanamide, CALCIUM ION, ...
Authors:Chen, Q, Yu, Y.
Deposit date:2019-08-07
Release date:2019-10-23
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.475 Å)
Cite:Reversible binding of the anticancer drug KXO1 (tirbanibulin) to the colchicine-binding site of beta-tubulin explains KXO1's low clinical toxicity.
J.Biol.Chem., 294, 2019
6L8F
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BU of 6l8f by Molmil
Crystal structure of heterotetrameric complex of YoeB-YefM toxin-antitoxin from Staphylococcus aureus.
Descriptor: Antitoxin, YoeB
Authors:Yue, J, Xue, L.
Deposit date:2019-11-06
Release date:2020-09-02
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Distinct oligomeric structures of the YoeB-YefM complex provide insights into the conditional cooperativity of type II toxin-antitoxin system.
Nucleic Acids Res., 48, 2020
6L8E
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BU of 6l8e by Molmil
Crystal structure of heterohexameric YoeB-YefM complex bound to 26bp-DNA
Descriptor: DNA (26-mer), YefM Antitoxin, YoeB toxin
Authors:Yue, J, Xue, L.
Deposit date:2019-11-06
Release date:2020-09-02
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Distinct oligomeric structures of the YoeB-YefM complex provide insights into the conditional cooperativity of type II toxin-antitoxin system.
Nucleic Acids Res., 48, 2020
7DP8
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BU of 7dp8 by Molmil
Crystal structure of T2R-TTL-Cevipabulin-eribulin complex
Descriptor: (1S,3S,6S,9S,12S,14R,16R,18S,20R,21R,22S,26R,29S,31R,32S,33R,35R,36S)-20-[(2S)-3-amino-2-hydroxypropyl]-21-methoxy-14-methyl-8,15-dimethylidene-2,19,30,34,37,39,40,41-octaoxanonacyclo[24.9.2.1~3,32~.1~3,33~.1~6,9~.1~12,16~.0~18,22~.0~29,36~.0~31,35~]hentetracontan-24-one (non-preferred name), 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 6-[2,6-bis(fluoranyl)-4-[3-(methylamino)propoxy]phenyl]-5-chloranyl-N-[(2S)-1,1,1-tris(fluoranyl)propan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine, ...
Authors:Chen, L.J, Chen, Q, Yu, Y, Yang, J.H.
Deposit date:2020-12-18
Release date:2021-07-07
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.446 Å)
Cite:Cevipabulin-tubulin complex reveals a novel agent binding site on alpha-tubulin with tubulin degradation effect.
Sci Adv, 7, 2021
7DSJ
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BU of 7dsj by Molmil
Anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae in complex with PRPP and Mg
Descriptor: 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose, Anthranilate phosphoribosyltransferase, MAGNESIUM ION
Authors:Wu, X.
Deposit date:2020-12-31
Release date:2021-03-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:Crystal structures of anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 77, 2021
7DSM
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BU of 7dsm by Molmil
Anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae
Descriptor: Anthranilate phosphoribosyltransferase
Authors:Wu, X.
Deposit date:2020-12-31
Release date:2021-03-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Crystal structures of anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 77, 2021
7DSO
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BU of 7dso by Molmil
Anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae in complex with 4-fluoroanthranilate
Descriptor: 2-amino-4-fluorobenzoic acid, Anthranilate phosphoribosyltransferase
Authors:Wu, X.
Deposit date:2020-12-31
Release date:2021-03-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Crystal structures of anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 77, 2021
7DSR
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BU of 7dsr by Molmil
Anthranilate phosphoribosyltransferase variant Gly141Asn from Saccharomyces cerevisiae in complex with 4-fluoroanthranilate
Descriptor: 2-amino-4-fluorobenzoic acid, Anthranilate phosphoribosyltransferase
Authors:Wu, X.
Deposit date:2020-12-31
Release date:2021-03-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structures of anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 77, 2021
7DSP
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BU of 7dsp by Molmil
Anthranilate phosphoribosyltransferase variant Ser121Ala from Saccharomyces cerevisiae with Mg bound
Descriptor: Anthranilate phosphoribosyltransferase, MAGNESIUM ION
Authors:Wu, X.
Deposit date:2020-12-31
Release date:2021-03-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structures of anthranilate phosphoribosyltransferase from Saccharomyces cerevisiae.
Acta Crystallogr.,Sect.F, 77, 2021

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PDB entries from 2024-07-17

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