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1LW2
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BU of 1lw2 by Molmil
CRYSTAL STRUCTURE OF T215Y MUTANT HIV-1 REVERSE TRANSCRIPTASE IN COMPLEX WITH 1051U91
Descriptor: 6,11-DIHYDRO-11-ETHYL-6-METHYL-9-NITRO-5H-PYRIDO[2,3-B][1,5]BENZODIAZEPIN-5-ONE, HIV-1 REVERSE TRANSCRIPTASE, PHOSPHATE ION
Authors:Ren, J, Chamberlain, P.P, Nichols, C.E, Douglas, L, Stuart, D.I, Stammers, D.K.
Deposit date:2002-05-30
Release date:2002-10-30
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (3 Å)
Cite:Crystal structures of Zidovudine- or Lamivudine-resistant human immunodeficiency virus type 1 reverse transcriptases containing mutations at codons 41, 184, and 215.
J.Virol., 76, 2002
9GLI
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BU of 9gli by Molmil
Crystal Structure of UFC1 T106C
Descriptor: GLYCEROL, Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.426 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
7RPA
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BU of 7rpa by Molmil
X-ray crystal structure of OXA-24/40 K84D in complex with meropenem
Descriptor: (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, BICARBONATE ION, Beta-lactamase, ...
Authors:Powers, R.A, Mitchell, J.M, June, C.M.
Deposit date:2021-08-03
Release date:2022-07-06
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40.
J.Biol.Chem., 298, 2022
9GLL
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BU of 9gll by Molmil
Crystal Structure of UFC1 T106L
Descriptor: Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
1LWJ
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BU of 1lwj by Molmil
CRYSTAL STRUCTURE OF T. MARITIMA 4-ALPHA-GLUCANOTRANSFERASE/ACARBOSE COMPLEX
Descriptor: 4-ALPHA-GLUCANOTRANSFERASE, CALCIUM ION, MODIFIED ACARBOSE PENTASACCHARIDE
Authors:Roujeinikova, A, Raasch, C, Sedelnikova, S, Liebl, W, Rice, D.W.
Deposit date:2002-05-31
Release date:2002-08-14
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:CRYSTAL STRUCTURE OF THERMOTOGA MARITIMA 4-ALPHA-GLUCANOTRANSFERASE AND ITS ACARBOSE COMPLEX: IMPLICATIONS FOR SUBSTRATE SPECIFICITY AND CATALYSIS
J.Mol.Biol., 321, 2002
7RP8
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BU of 7rp8 by Molmil
X-ray crystal structure of OXA-24/40 K84D in complex with imipenem
Descriptor: Beta-lactamase, Imipenem, SULFATE ION
Authors:Powers, R.A, Mitchell, J.M, June, C.M.
Deposit date:2021-08-03
Release date:2022-07-06
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40.
J.Biol.Chem., 298, 2022
9G92
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BU of 9g92 by Molmil
Crystal structure of thioredoxin reductase from Cryptosporidium parvum in the "in" conformation
Descriptor: DI(HYDROXYETHYL)ETHER, DIMETHYL SULFOXIDE, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Gabriele, F, Palerma, M, Ardini, M, Bogard, J, Chen, X.M, Williams, D.L, Angelucci, F.
Deposit date:2024-07-24
Release date:2025-05-07
Last modified:2025-05-28
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Targeting Apicomplexan Parasites: Structural and Functional Characterization of Cryptosporidium Thioredoxin Reductase as a Novel Drug Target.
Biochemistry, 64, 2025
1M6X
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BU of 1m6x by Molmil
Flpe-Holliday Junction Complex
Descriptor: Flp recombinase, Symmetrized FRT site
Authors:Conway, A.B, Chen, Y, Rice, P.A.
Deposit date:2002-07-17
Release date:2003-02-04
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural Plasticity of the Flp-Holliday Junction Complex
J.Mol.Biol., 326, 2003
9GIW
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BU of 9giw by Molmil
Structure of the human mitochondrial pyruvate carrier inhibited by zaprinast
Descriptor: 5-(2-propoxyphenyl)-3,4-dihydro-[1,2,3]triazolo[4,5-d]pyrimidin-7-one, Mitochondrial pyruvate carrier 1-like protein, Mitochondrial pyruvate carrier 2, ...
Authors:Sichrovsky, M, Lacabanne, D, Ruprecht, J.J, Rana, J.J, Stanik, K, Dionysopoulou, M, Sowton, A.P, King, M.S, Jones, S, Cooper, L, Hardwick, S.W, Paris, G, Chirgadze, D.Y, Ding, S, Fearnley, I.M, Palmer, S, Pardon, E, Steyaert, J, Leone, V, Forrest, L.R, Tavoulari, S, Kunji, E.R.S.
Deposit date:2024-08-19
Release date:2025-05-07
Method:ELECTRON MICROSCOPY (3.92 Å)
Cite:Molecular basis of pyruvate transport and inhibition of the human mitochondrial pyruvate carrier.
Sci Adv, 11, 2025
9GLO
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BU of 9glo by Molmil
Crystal Structure of UFC1 C116E&T106S
Descriptor: GLYCEROL, SULFATE ION, Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.53 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
1LX7
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BU of 1lx7 by Molmil
Structure of E. coli uridine phosphorylase at 2.0A
Descriptor: uridine phosphorylase
Authors:Burling, T, Buglino, J.A, Kniewel, R, Chadna, T, Beckwith, A, Lima, C.D, Burley, S.K, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2002-06-04
Release date:2002-06-12
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of Escherichia coli uridine phosphorylase at 2.0 A.
Acta Crystallogr.,Sect.D, 59, 2003
9GIY
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BU of 9giy by Molmil
Structure of the human mitochondrial pyruvate carrier inhibited by mitoglitazone
Descriptor: Macrobody,Maltose/maltodextrin-binding periplasmic protein, Mitochondrial pyruvate carrier 1-like protein, Mitochondrial pyruvate carrier 2, ...
Authors:Sichrovsky, M, Lacabanne, D, Ruprecht, J.J, Rana, J.J, Stanik, K, Dionysopoulou, M, King, M.S, Sowton, A.P, Jones, S, Cooper, L, Hardwick, S.W, Paris, G, Chirgadze, D.Y, Ding, S, Fearnley, I.M, Palmer, S, Pardon, E, Steyaert, J, Leone, V, Forrest, L.R, Tavoulari, S, Kunji, E.R.S.
Deposit date:2024-08-19
Release date:2025-05-07
Method:ELECTRON MICROSCOPY (3.79 Å)
Cite:Molecular basis of pyruvate transport and inhibition of the human mitochondrial pyruvate carrier.
Sci Adv, 11, 2025
1M7V
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BU of 1m7v by Molmil
STRUCTURE OF A NITRIC OXIDE SYNTHASE HEME PROTEIN FROM BACILLUS SUBTILIS WITH TETRAHYDROFOLATE AND ARGININE BOUND
Descriptor: (6S)-5,6,7,8-TETRAHYDROFOLATE, ARGININE, Nitric Oxide Synthase, ...
Authors:Pant, K, Bilwes, A.M, Adak, S, Stuehr, D.J, Crane, B.R.
Deposit date:2002-07-22
Release date:2002-10-30
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structure of a nitric oxide synthase heme protein from Bacillus subtilis.
Biochemistry, 41, 2002
9GLK
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BU of 9glk by Molmil
Crystal Structure of UFC1 E149I
Descriptor: IMIDAZOLE, Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
1M8C
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BU of 1m8c by Molmil
SOLUTION STRUCTURE OF THE T State OF TURKEY OVOMUCOID AT PH 2.5
Descriptor: Ovomucoid
Authors:Song, J, Laskowski Jr, M, Qasim, M.A, Markley, J.L.
Deposit date:2002-07-24
Release date:2002-09-04
Last modified:2024-10-30
Method:SOLUTION NMR
Cite:Two conformational states of Turkey ovomucoid third domain at low pH: three-dimensional structures, internal dynamics, and interconversion kinetics and thermodynamics.
Biochemistry, 42, 2003
7R8Q
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BU of 7r8q by Molmil
Closed form of SAOUHSC_02373 in complex with ADP, citrate, Mg2+ and Na+
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ATP-grasp domain-containing protein, CITRIC ACID, ...
Authors:Pederick, J.L, Bruning, J.B.
Deposit date:2021-06-27
Release date:2022-09-14
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Discovery of an ʟ-amino acid ligase implicated in Staphylococcal sulfur amino acid metabolism.
J.Biol.Chem., 298, 2022
5F5Q
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BU of 5f5q by Molmil
Crystal structure of Canavalia virosa lectin in complex with alpha-methyl-mannoside
Descriptor: CALCIUM ION, Concanavalin-A, MANGANESE (II) ION, ...
Authors:Osterne, V.J.S, Silva-Filho, J.C, Pinto-Junior, V.R, Santiago, M.Q, Lossio, C.F, Delatorre, P, Nascimento, K.S, Cavada, B.S.
Deposit date:2015-12-04
Release date:2016-10-26
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Structural characterization of a lectin from Canavalia virosa seeds with inflammatory and cytotoxic activities.
Int.J.Biol.Macromol., 94, 2016
1M8S
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BU of 1m8s by Molmil
Crystal Structures of Cadmium-binding Acidic Phospholipase A2 from the Venom of Agkistrodon halys pallas at 1.9 Resolution (crystal grown at pH 5.9)
Descriptor: 1,4-BUTANEDIOL, CADMIUM ION, phospholipase a2
Authors:Xu, S, Gu, L, Zhou, Y, Lin, Z.
Deposit date:2002-07-25
Release date:2003-02-11
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structures of cadmium-binding acidic phospholipase A(2) from the venom of Agkistrodon halys Pallas at 1.9A resolutio
Biochem.Biophys.Res.Commun., 300, 2003
9GMN
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BU of 9gmn by Molmil
Crystal Structure of UFC1 T106V
Descriptor: Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-29
Release date:2025-05-07
Method:X-RAY DIFFRACTION (2 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
7RCU
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BU of 7rcu by Molmil
Synthetic Max homodimer mimic in complex with DNA
Descriptor: 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE, 2-(2,5-dioxopyrrolidin-1-yl)acetamide, ACETAMIDE, ...
Authors:Speltz, T, Qiao, Z, Shangguan, S, Fanning, S, Greene, J, Moellering, R.
Deposit date:2021-07-08
Release date:2022-09-14
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.69 Å)
Cite:Targeting MYC with modular synthetic transcriptional repressors derived from bHLH DNA-binding domains.
Nat.Biotechnol., 41, 2023
9GLJ
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BU of 9glj by Molmil
Crystal Structure of UFC1 T106A
Descriptor: Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.213 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
1LXN
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BU of 1lxn by Molmil
X-RAY STRUCTURE OF MTH1187 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET TT272
Descriptor: HYPOTHETICAL PROTEIN MTH1187, SULFATE ION
Authors:Tao, X, Khayat, R, Christendat, D, Savchenko, A, Xu, X, Edwards, A, Arrowsmith, C.H, Tong, L, Northeast Structural Genomics Consortium (NESG)
Deposit date:2002-06-05
Release date:2003-07-29
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Structures of MTH1187 and its Yeast Ortholog YBL001C
Proteins, 52, 2003
9GLM
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BU of 9glm by Molmil
Crystal Structure of UFC1 W145F
Descriptor: GLYCEROL, Ubiquitin-fold modifier-conjugating enzyme 1
Authors:Kumar, M, Banerjee, S, Wiener, R.
Deposit date:2024-08-27
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:UFC1 reveals the multifactorial and plastic nature of oxyanion holes in E2 conjugating enzymes.
Nat Commun, 16, 2025
1LYD
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BU of 1lyd by Molmil
CRYSTAL STRUCTURE OF T4-LYSOZYME GENERATED FROM SYNTHETIC CODING DNA EXPRESSED IN ESCHERICHIA COLI
Descriptor: T4 LYSOZYME
Authors:Rose, D.R.
Deposit date:1989-01-11
Release date:1990-04-15
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal structure of T4-lysozyme generated from synthetic coding DNA expressed in Escherichia coli.
Protein Eng., 2, 1988
9GQV
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BU of 9gqv by Molmil
Pseudomonas aeruginosa FabF C164A in complex with N-((1-((2-hydroxy-4-methylpentanamido)methyl)cyclobutyl)methyl)-1H-pyrazole-3-carboxamide
Descriptor: 3-oxoacyl-[acyl-carrier-protein] synthase 2, CHLORIDE ION, DIMETHYL SULFOXIDE, ...
Authors:Yadrykhins'ky, V, Brenk, R.
Deposit date:2024-09-09
Release date:2025-05-07
Method:X-RAY DIFFRACTION (1.766 Å)
Cite:Towards new antibiotics: P. aeruginosa FabF ligands discovered by crystallographic fragment screening followed by hit expansion.
Eur.J.Med.Chem., 291, 2025

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数据于2025-10-29公开中

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