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8ZVV
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BU of 8zvv by Molmil
human citrate synthase complexed with citrate
Descriptor: CITRIC ACID, Citrate synthase, mitochondrial
Authors:Yang, L.Y, Fang, Y.J.
Deposit date:2024-06-12
Release date:2025-06-18
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:human citrate synthase complexed with citrate
To Be Published
8ZXG
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BU of 8zxg by Molmil
Crystal structure of Paraoxonase from Bacillus sp. strain S3wahi
Descriptor: GLYCEROL, MAGNESIUM ION, Paraoxonase from Bacillus sp. strain S3wahi, ...
Authors:Azman, A.A, Muhd Noor, N.D, Leow, A.T.C, Mohd Noor, S.A, Mohamad Ali, M.S.
Deposit date:2024-06-14
Release date:2025-06-18
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (1.494 Å)
Cite:Crystal structure analysis of Paraoxonase from Bacillus sp. strain S3wahi
To Be Published
2HZK
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BU of 2hzk by Molmil
Crystal structures of a sodium-alpha-keto acid binding subunit from a TRAP transporter in its open form
Descriptor: GLYCEROL, TRAP-T family sorbitol/mannitol transporter, periplasmic binding protein, ...
Authors:Gonin, S, Arnoux, P, Pierru, B, Alonso, B, Sabaty, M, Pignol, D.
Deposit date:2006-08-09
Release date:2007-04-03
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal structures of an Extracytoplasmic Solute Receptor from a TRAP transporter in its open and closed forms reveal a helix-swapped dimer requiring a cation for alpha-keto acid binding.
Bmc Struct.Biol., 7, 2007
8ZXB
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BU of 8zxb by Molmil
Structure of aminotransferase from Mycolicibacterium neoaurum in complex with PLP
Descriptor: Branched-chain amino acid aminotransferase, PYRIDOXAL-5'-PHOSPHATE
Authors:Wei, H, Cong, L, Wang, J, You, S, Liu, W.
Deposit date:2024-06-14
Release date:2025-06-18
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structure of aminotransferase from Mycolicibacterium neoaurum in complex with PLP
To Be Published
5JRS
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BU of 5jrs by Molmil
CRYSTAL STRUCTURE OF BRUTON AGAMMAGLOBULINEMIA TYROSINE KINASE COMPLEXED WITH 4-[2-FLUORO-3-(4-OXO -3,4-DIHYDROQUINAZOLIN-3-YL)PHENYL]-7-(2-HYDROXYPROPAN-2-Y L)-9H-CARBAZOLE-1-CARBOXAMIDE
Descriptor: 4-[2-fluoro-3-(4-oxoquinazolin-3(4H)-yl)phenyl]-7-(2-hydroxypropan-2-yl)-9H-carbazole-1-carboxamide, Tyrosine-protein kinase BTK
Authors:Muckelbauer, J.K.
Deposit date:2016-05-06
Release date:2016-08-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Small Molecule Reversible Inhibitors of Bruton's Tyrosine Kinase (BTK): Structure-Activity Relationships Leading to the Identification of 7-(2-Hydroxypropan-2-yl)-4-[2-methyl-3-(4-oxo-3,4-dihydroquinazolin-3-yl)phenyl]-9H-carbazole-1-carboxamide (BMS-935177).
J.Med.Chem., 59, 2016
2I3V
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BU of 2i3v by Molmil
Measurement of conformational changes accompanying desensitization in an ionotropic glutamate receptor: Structure of G725C mutant
Descriptor: GLUTAMIC ACID, Glutamate receptor 2, ZINC ION
Authors:Armstrong, N, Jasti, J, Beich-Frandsen, M, Gouaux, E.
Deposit date:2006-08-21
Release date:2006-10-17
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Measurement of Conformational Changes accompanying Desensitization in an Ionotropic Glutamate Receptor.
Cell(Cambridge,Mass.), 127, 2006
8ZXY
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BU of 8zxy by Molmil
sweet protein MNEI-Mut 6-2
Descriptor: Monellin chain B,Monellin chain A
Authors:You, T.J, Liu, S.
Deposit date:2024-06-15
Release date:2025-06-18
Last modified:2025-07-09
Method:X-RAY DIFFRACTION (1.43 Å)
Cite:Structural Basis for the Exceptional Thermal Stability of the Boiling-Resistant Sweet Protein MNEI.
J.Agric.Food Chem., 73, 2025
8ZU4
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BU of 8zu4 by Molmil
Crystal Structure of Methyl parathion hydrolase mutant A127L/I145L/Q272D/S279A/S304P
Descriptor: Methyl parathion hydrolase, ZINC ION
Authors:Xu, F, Fan, S.
Deposit date:2024-06-07
Release date:2025-06-11
Method:X-RAY DIFFRACTION (1.39 Å)
Cite:Crystal Structure of Methyl parathion hydrolase mutant A127L/I145L/Q272D/S279A/S304P
To Be Published
2I4G
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BU of 2i4g by Molmil
Structural studies of protein tyrosine phosphatase beta catalytic domain in complex with a sulfamic acid (soaking experiment)
Descriptor: CHLORIDE ION, N-(TERT-BUTOXYCARBONYL)-L-TYROSYL-N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE, Receptor-type tyrosine-protein phosphatase beta
Authors:Evdokimov, A.G, Pokross, M.E, Walter, R.L, Mekel, M.
Deposit date:2006-08-21
Release date:2006-08-29
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Engineering the catalytic domain of human protein tyrosine phosphatase beta for structure-based drug discovery.
Acta Crystallogr.,Sect.D, 62, 2006
8ZXJ
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BU of 8zxj by Molmil
Sweet protein MNEI-Mut 6-1
Descriptor: Monellin chain B,Monellin chain A
Authors:You, T.J, Liu, S.
Deposit date:2024-06-14
Release date:2025-06-18
Last modified:2025-07-09
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural Basis for the Exceptional Thermal Stability of the Boiling-Resistant Sweet Protein MNEI.
J.Agric.Food Chem., 73, 2025
8ZXI
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BU of 8zxi by Molmil
Peptide channel interactions in the truncated VhChiP nanopore
Descriptor: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE, ASP-GLY-ALA-ASN-SER-ASP, Chitoporin, ...
Authors:Sanram, S, Suginta, W, Robinson, R.C.
Deposit date:2024-06-14
Release date:2025-06-18
Method:X-RAY DIFFRACTION (3.12 Å)
Cite:Structure and function of truncated VhChiP
To Be Published
5JW5
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BU of 5jw5 by Molmil
Structure of MEDI8852 Fab Fragment
Descriptor: MEDI8852 Heavy chain, MEDI8852 Light chain, PHOSPHATE ION
Authors:Neu, U, Collins, P.J, Walker, P.A, Vorlaender, M.K, Ogrodowicz, R.W, Martin, S.R, Gamblin, S.J, Skehel, J.J.
Deposit date:2016-05-11
Release date:2016-08-03
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure and Function Analysis of an Antibody Recognizing All Influenza A Subtypes.
Cell, 166, 2016
2I0G
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BU of 2i0g by Molmil
Benzopyrans are Selective Estrogen Receptor beta Agonists (SERBAs) with Novel Activity in Models of Benign Prostatic Hyperplasia
Descriptor: (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, Estrogen receptor beta
Authors:Wang, Y.
Deposit date:2006-08-10
Release date:2006-10-24
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Benzopyrans are selective estrogen receptor Beta agonists with novel activity in models of benign prostatic hyperplasia.
J.Med.Chem., 49, 2006
8HO8
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BU of 8ho8 by Molmil
The cryo-EM structure of cellobiose phosphorylase from Clostridium thermocellum in complex with cellobiose
Descriptor: Cellobiose phosphorylase, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose
Authors:Iriya, S, Kuga, T, Sunagawa, N, Igarashi, K.
Deposit date:2022-12-09
Release date:2023-12-13
Method:ELECTRON MICROSCOPY (2.24 Å)
Cite:The cryo-EM structure of cellobiose phosphorylase from Clostridium thermocellum in complex with cellobiose
To Be Published
7RTK
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BU of 7rtk by Molmil
Structure of the (NIAU)2 complex with N-terminal mutation of ISCU2 Y35D at 2.5 A resolution
Descriptor: 1,2-ETHANEDIOL, 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, ...
Authors:Boniecki, M.T, Cygler, M.
Deposit date:2021-08-13
Release date:2021-08-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The essential function of ISCU2 and its conserved N-terminus in Fe/S cluster biogenesis
To Be Published
2I0T
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BU of 2i0t by Molmil
Crystal structure of phenylacetaldehyde derived R-carbinolamine adduct of aromatic amine dehydrogenase
Descriptor: 2-PHENYL-ETHANOL, Aromatic amine dehydrogenase
Authors:Roujeinikova, A, Leys, D.
Deposit date:2006-08-11
Release date:2007-04-24
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:New insights into the reductive half-reaction mechanism of aromatic amine dehydrogenase revealed by reaction with carbinolamine substrates.
J.Biol.Chem., 282, 2007
8ZW1
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BU of 8zw1 by Molmil
citrate synthases complexed with oxaloacetate and acetyl-CoA
Descriptor: ACETYL COENZYME *A, CITRIC ACID, COENZYME A, ...
Authors:Yang, L.Y, Fang, Y.J.
Deposit date:2024-06-12
Release date:2025-06-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:citrate synthases complexed with oxaloacetate and acetyl-CoA
To Be Published
6LFL
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BU of 6lfl by Molmil
Crystal structure of a class A GPCR
Descriptor: 4-[[3,4-bis(oxidanylidene)-2-[[(1~{R})-1-(4-propan-2-ylfuran-2-yl)propyl]amino]cyclobuten-1-yl]amino]-~{N},~{N}-dimethyl-3-oxidanyl-pyridine-2-carboxamide, C-X-C chemokine receptor type 2,GlgA glycogen synthase,C-X-C chemokine receptor type 2
Authors:Liu, Z.J, Hua, T, Liu, K.W, Wu, L.J.
Deposit date:2019-12-03
Release date:2020-09-02
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Structural basis of CXC chemokine receptor 2 activation and signalling.
Nature, 585, 2020
8ZWQ
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BU of 8zwq by Molmil
pseudorabies virus dUTPase structure
Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, MAGNESIUM ION, dUTPase
Authors:Wang, Y.
Deposit date:2024-06-13
Release date:2025-06-18
Method:X-RAY DIFFRACTION (2.23 Å)
Cite:Structural definition of pseudorabies virus dUTPase reveals a novel folding dimer in the herpesviruses family
To Be Published
2VHL
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BU of 2vhl by Molmil
The Three-dimensional structure of the N-Acetylglucosamine-6- phosphate deacetylase from Bacillus subtilis
Descriptor: 2-amino-2-deoxy-6-O-phosphono-alpha-D-glucopyranose, FE (III) ION, N-ACETYLGLUCOSAMINE-6-PHOSPHATE DEACETYLASE, ...
Authors:Vincent, F, Yates, D, Garman, E, Davies, G.J.
Deposit date:2007-11-22
Release date:2007-12-04
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:The Three-Dimensional Structure of the N-Acetylglucosamine-6-Phosphate Deacetylase from Bacillus Subtilis
J.Biol.Chem., 279, 2004
8ZYB
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BU of 8zyb by Molmil
a-KG dependent oxygenase
Descriptor: DhiD, FE (III) ION
Authors:Fan, A, Fan, S, Wu, M, Sun, Z.
Deposit date:2024-06-17
Release date:2025-06-18
Method:X-RAY DIFFRACTION (2.58 Å)
Cite:a-KG dependent oxygenase
To Be Published
8ZWT
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BU of 8zwt by Molmil
Crystal structure of atypical two cysteine thiol peroxidase from Staphylococcus aureus
Descriptor: (2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, Thiol peroxidase
Authors:Shukla, M, Maji, S, Yadav, V.K, Bhattacharyya, S.
Deposit date:2024-06-13
Release date:2025-06-18
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structure of atypical two cysteine thiol peroxidase from Staphylococcus aureus
To Be Published
5JQC
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BU of 5jqc by Molmil
Crystal structure putative autolysin from Listeria monocytogenes
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, Lmo1076 protein, ...
Authors:Chang, C, Zhou, M, Shatsman, S, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2016-05-04
Release date:2016-05-18
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.149 Å)
Cite:Crystal structure putative autolysin from Listeria monocytogenes
To Be Published
8ZU5
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BU of 8zu5 by Molmil
Crystal Structure of Methyl parathion hydrolase mutant A66D/I143V/I145L/Q272D/S279A/
Descriptor: Methyl parathion hydrolase, ZINC ION
Authors:Xu, F, Fan, S.
Deposit date:2024-06-07
Release date:2025-06-11
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Crystal Structure of Methyl parathion hydrolase mutant A66D/I143V/I145L/Q272D/S279A/
To Be Published
2I2A
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BU of 2i2a by Molmil
Crystal structure of LmNADK1 from Listeria monocytogenes
Descriptor: GLYCEROL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Probable inorganic polyphosphate/ATP-NAD kinase 1
Authors:Labesse, G.
Deposit date:2006-08-16
Release date:2007-08-07
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:NAD kinases use substrate-assisted catalysis for specific recognition of NAD.
J.Biol.Chem., 282, 2007

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PDB entries from 2025-07-09

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