7ZKA
 
 | ABCB1 V978C mutant (mABCB1) in the outward facing state bound to AAC | Descriptor: | (4~{S},11~{S},18~{S})-4,11-dimethyl-18-(sulfanylmethyl)-6,13,20-trithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.1^{5,8}.1^{12,15}]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione, ADENOSINE-5'-TRIPHOSPHATE, ATP-dependent translocase ABCB1, ... | Authors: | Parey, K, Januliene, D, Gewering, T, Urbatsch, I, Zhang, Q, Moeller, A. | Deposit date: | 2022-04-12 | Release date: | 2023-04-26 | Last modified: | 2024-11-06 | Method: | ELECTRON MICROSCOPY (2.9 Å) | Cite: | Tracing the substrate translocation mechanism in P-glycoprotein. Elife, 12, 2024
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6NNJ
 
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7ZK5
 
 | ABCB1 L335C mutant (mABCB1) in the outward facing state bound to AAC | Descriptor: | (4~{S},11~{S},18~{S})-4,11-dimethyl-18-(sulfanylmethyl)-6,13,20-trithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.1^{5,8}.1^{12,15}]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione, ADENOSINE-5'-TRIPHOSPHATE, ATP-dependent translocase ABCB1, ... | Authors: | Parey, K, Januliene, D, Gewering, T, Moeller, A. | Deposit date: | 2022-04-12 | Release date: | 2023-04-26 | Last modified: | 2024-11-20 | Method: | ELECTRON MICROSCOPY (2.6 Å) | Cite: | Tracing the substrate translocation mechanism in P-glycoprotein. Elife, 12, 2024
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7ZK9
 
 | ABCB1 L971C mutant (mABCB1) in the inward facing state | Descriptor: | (4~{S},11~{S},18~{S})-4,11-dimethyl-18-(sulfanylmethyl)-6,13,20-trithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.1^{5,8}.1^{12,15}]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione, ATP-dependent translocase ABCB1 | Authors: | Parey, K, Januliene, D, Gewering, T, Zhang, Q, Moeller, A. | Deposit date: | 2022-04-12 | Release date: | 2023-04-26 | Last modified: | 2024-03-20 | Method: | ELECTRON MICROSCOPY (4.3 Å) | Cite: | Tracing the substrate translocation mechanism in P-glycoprotein. Elife, 12, 2024
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6DO8
 
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6DOE
 
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6DPH
 
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5DNW
 
 | Crystal structure of KAI2-like protein from Striga (apo state 1) | Descriptor: | 1,2-ETHANEDIOL, FORMIC ACID, SODIUM ION, ... | Authors: | Xu, Y, Miyakawa, T, Nakamura, A, Tanokura, M. | Deposit date: | 2015-09-10 | Release date: | 2016-08-17 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (2.02 Å) | Cite: | Structural basis of unique ligand specificity of KAI2-like protein from parasitic weed Striga hermonthica Sci Rep, 6, 2016
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5ZRL
 
 | M. smegmatis antimutator protein MutT2 in complex with CDP | Descriptor: | 1,2-ETHANEDIOL, CYTIDINE-5'-DIPHOSPHATE, Putative mutator protein MutT2/NUDIX hydrolase | Authors: | Singh, A, Arif, S.M, Sang, P.B, Varshney, U, Vijayan, M. | Deposit date: | 2018-04-24 | Release date: | 2019-04-24 | Last modified: | 2023-11-22 | Method: | X-RAY DIFFRACTION (1.61 Å) | Cite: | Structural insights into the specificity and catalytic mechanism of mycobacterial nucleotide pool sanitizing enzyme MutT2. J.Struct.Biol., 204, 2018
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7ZK8
 
 | ABCB1 L971C mutant (mABCB1) in the outward facing state bound to AAC | Descriptor: | (4~{S},11~{S},18~{S})-4,11-dimethyl-18-(sulfanylmethyl)-6,13,20-trithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.1^{5,8}.1^{12,15}]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione, ADENOSINE-5'-TRIPHOSPHATE, ATP-dependent translocase ABCB1, ... | Authors: | Parey, K, Januliene, D, Gewering, T, Moeller, A. | Deposit date: | 2022-04-12 | Release date: | 2023-04-26 | Last modified: | 2024-11-13 | Method: | ELECTRON MICROSCOPY (3 Å) | Cite: | Tracing the substrate translocation mechanism in P-glycoprotein. Elife, 12, 2024
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5TC0
 
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7T7Q
 
 | R-27 In Complex with S. aureus DHFR and alpha-NADPH - Remediated for comparison with tNADPH | Descriptor: | 6-ethyl-5-{(3R)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine, ACETATE ION, Dihydrofolate reductase, ... | Authors: | Reeve, S.M, Wang, S, Donald, B.R, Wright, D.L. | Deposit date: | 2021-12-15 | Release date: | 2022-02-02 | Last modified: | 2023-10-18 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Chiral evasion and stereospecific antifolate resistance in Staphylococcus aureus. Plos Comput.Biol., 18, 2022
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1K1X
 
 | Crystal structure of 4-alpha-glucanotransferase from thermococcus litoralis | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-ALPHA-GLUCANOTRANSFERASE, CALCIUM ION | Authors: | Imamura, H, Fushinobu, S, Kumasaka, T, Yamamoto, M, Jeon, B.S, Wakagi, T, Matsuzawa, H. | Deposit date: | 2001-09-26 | Release date: | 2003-06-17 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Crystal structures of 4-alpha-glucanotransferase from Thermococcus litoralis and its complex with an inhibitor J.BIOL.CHEM., 278, 2003
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5TD2
 
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9BJT
 
 | X-ray crystal structure of Y62F Thermothelomyces thermophilus polysaccharide monooxygenase 9E | Descriptor: | 1,2-ETHANEDIOL, COPPER (II) ION, Glycoside hydrolase family 61 protein, ... | Authors: | Thomas, W.C, Sayler, R.I, Marletta, M.A. | Deposit date: | 2024-04-25 | Release date: | 2024-12-18 | Last modified: | 2025-01-22 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | Electron transfer in polysaccharide monooxygenase catalysis. Proc.Natl.Acad.Sci.USA, 122, 2025
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6DOF
 
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6DPA
 
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5ZVX
 
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5K6Q
 
 | Crystal structure of Arabidopsis thaliana acetohydroxyacid synthase catalytic subunit | Descriptor: | 2-[(2E)-3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-2-(1-HYDROXYETHYLIDENE)-4-METHYL-2,3-DIHYDRO-1,3-THIAZOL-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE, 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Acetolactate synthase, ... | Authors: | Garcia, M.D, Wang, J.-G, Lonhienne, T, Guddat, L.W. | Deposit date: | 2016-05-25 | Release date: | 2017-05-31 | Last modified: | 2024-10-30 | Method: | X-RAY DIFFRACTION (2.952 Å) | Cite: | Crystal structure of plant acetohydroxyacid synthase, the target for several commercial herbicides. FEBS J., 284, 2017
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9BJS
 
 | X-ray crystal structure of Y62W Thermothelomyces thermophilus polysaccharide monooxygenase 9E | Descriptor: | 1,2-ETHANEDIOL, ACETIC ACID, COPPER (II) ION, ... | Authors: | Thomas, W.C, Sayler, R.I, Marletta, M.A. | Deposit date: | 2024-04-25 | Release date: | 2024-12-18 | Last modified: | 2025-01-22 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Electron transfer in polysaccharide monooxygenase catalysis. Proc.Natl.Acad.Sci.USA, 122, 2025
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9BJR
 
 | X-ray crystal structure of Y168F variant Thermothelomyces thermophilus polysaccharide monooxygenase 9E | Descriptor: | 1,2-ETHANEDIOL, ACETATE ION, COPPER (II) ION, ... | Authors: | Thomas, W.C, Sayler, R.I, Marletta, M.A. | Deposit date: | 2024-04-25 | Release date: | 2024-12-18 | Last modified: | 2025-01-22 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Electron transfer in polysaccharide monooxygenase catalysis. Proc.Natl.Acad.Sci.USA, 122, 2025
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6DPL
 
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9BJQ
 
 | X-ray crystal structure of wild-type Thermothelomyces thermophilus polysaccharide monooxygenase 9E | Descriptor: | 1,2-ETHANEDIOL, ACETATE ION, COPPER (II) ION, ... | Authors: | Thomas, W.C, Sayler, R.I, Marletta, M.A. | Deposit date: | 2024-04-25 | Release date: | 2024-12-18 | Last modified: | 2025-01-22 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Electron transfer in polysaccharide monooxygenase catalysis. Proc.Natl.Acad.Sci.USA, 122, 2025
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5DTJ
 
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4WJK
 
 | Metal Ion and Ligand Binding of Integrin | Descriptor: | 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ... | Authors: | Xia, W, Springer, T.A. | Deposit date: | 2014-09-30 | Release date: | 2014-12-03 | Last modified: | 2024-11-13 | Method: | X-RAY DIFFRACTION (1.85 Å) | Cite: | Metal ion and ligand binding of integrin alpha 5 beta 1. Proc.Natl.Acad.Sci.USA, 111, 2014
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