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1VQE
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BU of 1vqe by Molmil
GENE V PROTEIN MUTANT WITH VAL 35 REPLACED BY ILE 35 AND ILE 47 REPLACED BY MET 47 (V35I, I47M)
Descriptor: GENE V PROTEIN
Authors:Skinner, M.M, Terwilliger, T.C.
Deposit date:1996-08-14
Release date:1997-02-12
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Potential use of additivity of mutational effects in simplifying protein engineering.
Proc.Natl.Acad.Sci.USA, 93, 1996
1VQC
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BU of 1vqc by Molmil
GENE V PROTEIN MUTANT WITH VAL 35 REPLACED BY ILE 35 AND ILE 47 REPLACED BY PHE 47 (V35I, I47F)
Descriptor: GENE V PROTEIN
Authors:Skinner, M.M, Terwilliger, T.C.
Deposit date:1996-08-14
Release date:1997-02-12
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Potential use of additivity of mutational effects in simplifying protein engineering.
Proc.Natl.Acad.Sci.USA, 93, 1996
4R8U
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BU of 4r8u by Molmil
S-SAD structure of DINB-DNA Complex
Descriptor: 5'-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]thymidine, DNA, DNA polymerase IV, ...
Authors:Kottur, J, Nair, D.T, Weinert, T, Oligeric, V, Wang, M.
Deposit date:2014-09-03
Release date:2015-01-14
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Fast native-SAD phasing for routine macromolecular structure determination
Nat.Methods, 12, 2015
4JUE
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BU of 4jue by Molmil
Crystal structure of Plasmodium falciparum ubiquitin conjugating enzyme UBC9
Descriptor: Ubiquitin conjugating enzyme UBC9
Authors:Reiter, K.H, Boucher, L.E, Bosch, J, Matunis, J.M.
Deposit date:2013-03-24
Release date:2013-08-21
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.851 Å)
Cite:Identification of Biochemically Distinct Properties of the Small Ubiquitin-related Modifier (SUMO) Conjugation Pathway in Plasmodium falciparum.
J.Biol.Chem., 288, 2013
4RZ8
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BU of 4rz8 by Molmil
Crystal structure of HIV-1 gp120 core in complex with NBD-11021, a small molecule CD4-antagonist
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 5-(4-chlorophenyl)-N-{(S)-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl][(2R)-piperidin-2-yl]methyl}-1H-pyrrole-2-carboxamide, ...
Authors:Kwon, Y.D, Debnath, A.K, Kwong, P.D.
Deposit date:2014-12-18
Release date:2015-09-09
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure-Based Design of a Small Molecule CD4-Antagonist with Broad Spectrum Anti-HIV-1 Activity.
J.Med.Chem., 58, 2015
4PGO
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BU of 4pgo by Molmil
Crystal structure of hypothetical protein PF0907 from Pyrococcus furiosus solved by sulfur SAD using Swiss Light Source data
Descriptor: CHLORIDE ION, Uncharacterized protein
Authors:Weinert, T, Waltersperger, S, Olieric, V, Panepucci, E, Chen, L, Rose, J.P, Wang, M, Wang, B.C, Southeast Collaboratory for Structural Genomics (SECSG)
Deposit date:2014-05-02
Release date:2014-12-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Fast native-SAD phasing for routine macromolecular structure determination.
Nat.Methods, 12, 2015
4PII
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BU of 4pii by Molmil
Crystal structure of hypothetical protein PF0907 from pyrococcus furiosus solved by sulfur SAD using Swiss light source data
Descriptor: CHLORIDE ION, IMIDAZOLE, N-glycosylase/DNA lyase
Authors:Weinert, T, Waltersperger, S, Olieric, V, Panepucci, E, Chen, L, Rose, J.P, Wang, M, Wang, B.C, Southeast Collaboratory for Structural Genomics (SECSG)
Deposit date:2014-05-08
Release date:2014-12-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Fast native-SAD phasing for routine macromolecular structure determination.
Nat.Methods, 12, 2015
4TNO
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BU of 4tno by Molmil
Hypothetical protein PF1117 from Pyrococcus Furiosus: Structure solved by sulfur-SAD using Swiss Light Source Data
Descriptor: CHLORIDE ION, CRISPR-associated endoribonuclease Cas2
Authors:Weinert, T, Waltersperger, S, Olieric, V, Panepucci, E, Chen, L, Rose, J.P, Wang, M, Wang, B.C, Southeast Collaboratory for Structural Genomics (SECSG)
Deposit date:2014-06-04
Release date:2014-12-10
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Fast native-SAD phasing for routine macromolecular structure determination.
Nat.Methods, 12, 2015
1RYQ
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BU of 1ryq by Molmil
Putative DNA-directed RNA polymerase, subunit e'' from Pyrococcus Furiosus Pfu-263306-001
Descriptor: DNA-directed RNA polymerase, subunit e'', ZINC ION
Authors:Liu, Z.-J, Chen, L, Tempel, W, Shah, A, Arendall III, W.B, Rose, J.P, Brereton, P.S, Izumi, M, Jenney Jr, F.E, Lee, H.S, Poole II, F.L, Shah, C, Sugar, F.J, Adams, M.W.W, Richardson, D.C, Richardson, J.S, Wang, B.-C, Southeast Collaboratory for Structural Genomics (SECSG)
Deposit date:2003-12-22
Release date:2004-08-10
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Parameter-space screening: a powerful tool for high-throughput crystal structure determination.
Acta Crystallogr.,Sect.D, 61, 2005
4REE
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BU of 4ree by Molmil
Crystal Structure of TR3 LBD in complex with Molecule 6
Descriptor: 1-(2,3,4-trihydroxyphenyl)nonan-1-one, GLYCEROL, Nuclear receptor subfamily 4 group A member 1
Authors:Li, F.W, Cai, Q.X, Li, A.Z, Tian, X.Y, Wang, W.J, Yuan, W, Hou, P.P, Wu, Q, Lin, T.W.
Deposit date:2014-09-22
Release date:2015-09-09
Last modified:2024-12-25
Method:X-RAY DIFFRACTION (2.37 Å)
Cite:Induction of Autophagic Death in Cancer Cells by Agonizing TR3 and Attenuating Akt2 Activity
Chem.Biol., 22, 2015
4QVX
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BU of 4qvx by Molmil
Discovery of a Potent and Selective BCL-XL Inhibitor That Demonstrates Thrombocytopenia and Inhibits Tumor Growth in Vivo
Descriptor: 2-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl]-5-(3-{4-[3-(dimethylamino)prop-1-yn-1-yl]-2-fluorophenoxy}propyl)-1,3-thiazole-4-carboxylic acid, Bcl-2-like protein 1
Authors:Park, C.H.
Deposit date:2014-07-16
Release date:2015-07-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of a Potent and Selective BCL-XL Inhibitor with in Vivo Activity.
ACS MED.CHEM.LETT., 5, 2014
1L5Z
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BU of 1l5z by Molmil
CRYSTAL STRUCTURE OF THE E121K SUBSTITUTION OF THE RECEIVER DOMAIN OF SINORHIZOBIUM MELILOTI DCTD
Descriptor: C4-DICARBOXYLATE TRANSPORT TRANSCRIPTIONAL REGULATORY PROTEIN DCTD, GLYCEROL, SULFATE ION
Authors:Park, S, Meyer, M, Jones, A.D, Yennawar, H.P, Yennawar, N.H, Nixon, B.T.
Deposit date:2002-03-08
Release date:2002-10-23
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2 Å)
Cite:Two-component signaling in the AAA + ATPase DctD: binding Mg2+ and BeF3- selects between alternate dimeric states of the receiver domain
FASEB J., 16, 2002
1L5Y
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BU of 1l5y by Molmil
CRYSTAL STRUCTURE OF MG2+ / BEF3-BOUND RECEIVER DOMAIN OF SINORHIZOBIUM MELILOTI DCTD
Descriptor: BERYLLIUM DIFLUORIDE, BERYLLIUM TETRAFLUORIDE ION, BERYLLIUM TRIFLUORIDE ION, ...
Authors:Park, S, Meyer, M, Jones, A.D, Yennawar, H.P, Yennawar, N.H, Nixon, B.T.
Deposit date:2002-03-08
Release date:2002-10-23
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Two-component signaling in the AAA + ATPase DctD: binding Mg2+ and BeF3- selects between alternate dimeric states of the receiver domain
FASEB J., 16, 2002
3RDY
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BU of 3rdy by Molmil
Crystal Structure of buckwheat trypsin inhibitor rBTI at 1.84 angstrom resolution
Descriptor: BWI-1=PROTEASE inhibitor/trypsin inhibitor
Authors:Wang, L.F, Li, M, Chang, W.R.
Deposit date:2011-04-02
Release date:2011-07-06
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Conformational Changes of rBTI from Buckwheat upon Binding to Trypsin: Implications for the Role of the P(8)' Residue in the Potato Inhibitor I Family
Plos One, 6, 2011
3RE1
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BU of 3re1 by Molmil
Crystal structure of uroporphyrinogen III synthase from Pseudomonas syringae pv. tomato DC3000
Descriptor: Uroporphyrinogen-III synthetase
Authors:Chang, W.R, Li, M, Peng, S.X.
Deposit date:2011-04-02
Release date:2011-06-22
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of uroporphyrinogen III synthase from Pseudomonas syringae pv. tomato DC3000
Biochem.Biophys.Res.Commun., 408, 2011
3RDZ
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BU of 3rdz by Molmil
Crystal Structure of rBTI-trypsin complex at 2.26 angstrom resolution
Descriptor: BWI-1=PROTEASE inhibitor/trypsin inhibitor, CALCIUM ION, Cationic trypsin
Authors:Wang, L.F, Li, M, Chang, W.R.
Deposit date:2011-04-02
Release date:2011-07-06
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.262 Å)
Cite:Conformational Changes of rBTI from Buckwheat upon Binding to Trypsin: Implications for the Role of the P(8)' Residue in the Potato Inhibitor I Family
Plos One, 6, 2011
7LAW
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BU of 7law by Molmil
crystal structure of GITR complex with GITR-L
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Tumor necrosis factor ligand superfamily member 18, Tumor necrosis factor receptor superfamily member 18
Authors:Longenecker, K.L, Rogers, B, Bigelow, L, Judge, R.A, Alvarez, H.
Deposit date:2021-01-07
Release date:2022-03-09
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.752 Å)
Cite:An anti-PD-1-GITR-L bispecific agonist induces GITR clustering-mediated T cell activation for cancer immunotherapy.
Nat Cancer, 3, 2022
7QLB
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BU of 7qlb by Molmil
SMYD3 in complex with fragment FL06268
Descriptor: 1-methylimidazole-4-sulfonamide, Histone-lysine N-methyltransferase SMYD3, S-ADENOSYLMETHIONINE, ...
Authors:Lund, B.A, Cederfelt, D, Dobritzsch, D.
Deposit date:2021-12-20
Release date:2023-03-29
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Identification of fragments targeting SMYD3 using highly sensitive kinetic and multiplexed biosensor-based screening
Rsc Med Chem, 2024
7QNR
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BU of 7qnr by Molmil
SMYD3 in complex with fragment FL01791
Descriptor: 3-propan-2-yl-1,2,4-thiadiazol-5-amine, Histone-lysine N-methyltransferase SMYD3, S-ADENOSYLMETHIONINE, ...
Authors:Lund, B.A, Cederfelt, D, Dobritzsch, D.
Deposit date:2021-12-22
Release date:2023-04-05
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.57 Å)
Cite:Identification of fragments targeting SMYD3 using highly sensitive kinetic and multiplexed biosensor-based screening
Rsc Med Chem, 2024
7QNU
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BU of 7qnu by Molmil
SMYD3 in complex with fragment FL08619
Descriptor: BENZOYL-FORMIC ACID, Histone-lysine N-methyltransferase SMYD3, S-ADENOSYLMETHIONINE, ...
Authors:Lund, B.A, Cederfelt, D, Dobritzsch, D.
Deposit date:2021-12-22
Release date:2023-04-05
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Identification of fragments targeting SMYD3 using highly sensitive kinetic and multiplexed biosensor-based screening
Rsc Med Chem, 2024
9JE0
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BU of 9je0 by Molmil
Human URAT1 bound to benzbromarone
Descriptor: Solute carrier family 22 member 12, [3,5-bis(bromanyl)-4-oxidanyl-phenyl]-(2-ethyl-1-benzofuran-3-yl)methanone
Authors:Wu, C, Zhang, C, Jin, S, Wang, J.J, Dai, A, Jiang, Y, Yang, D, Xu, H.E.
Deposit date:2024-09-01
Release date:2024-10-16
Last modified:2025-04-16
Method:ELECTRON MICROSCOPY (3.23 Å)
Cite:Molecular mechanisms of urate transport by the native human URAT1 and its inhibition by anti-gout drugs.
Cell Discov, 11, 2025
9JDV
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BU of 9jdv by Molmil
Human URAT1 bound with Uric acid
Descriptor: Solute carrier family 22 member 12, URIC ACID
Authors:Wu, C, Zhang, C, Jin, S, Wang, J.J, Jiang, Y, Yang, D, Xu, H.E.
Deposit date:2024-09-01
Release date:2024-10-16
Last modified:2025-04-16
Method:ELECTRON MICROSCOPY (3.32 Å)
Cite:Molecular mechanisms of urate transport by the native human URAT1 and its inhibition by anti-gout drugs.
Cell Discov, 11, 2025
9JDY
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BU of 9jdy by Molmil
Human URAT1 bound with verinurad
Descriptor: Solute carrier family 22 member 12, verinurad
Authors:Wu, C, Zhang, C, Jin, S, Wang, J.J, Dai, A, Jiang, Y, Yang, D, Xu, H.E.
Deposit date:2024-09-01
Release date:2024-10-16
Last modified:2025-04-16
Method:ELECTRON MICROSCOPY (3.23 Å)
Cite:Molecular mechanisms of urate transport by the native human URAT1 and its inhibition by anti-gout drugs.
Cell Discov, 11, 2025
9JE1
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BU of 9je1 by Molmil
Human URAT1 bound to dotinurad
Descriptor: Solute carrier family 22 member 12, dotinurad
Authors:Wu, C, Zhang, C, Jin, S, Wang, J.J, Dai, A, Jiang, Y, Yang, D, Xu, H.E.
Deposit date:2024-09-01
Release date:2024-10-16
Last modified:2025-04-16
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Molecular mechanisms of urate transport by the native human URAT1 and its inhibition by anti-gout drugs.
Cell Discov, 11, 2025
5Z8I
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BU of 5z8i by Molmil
Solution structure of the SBDbeta domain of yeast Ssa1
Descriptor: Heat shock protein SSA1
Authors:Gong, W, Hu, W, Wu, H, Perrett, S.
Deposit date:2018-01-31
Release date:2018-09-26
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:The C-terminal GGAP motif of Hsp70 mediates substrate recognition and stress response in yeast.
J. Biol. Chem., 293, 2018

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數據於2025-07-09公開中

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