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9K8Q
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BU of 9k8q by Molmil
Structure of Promiscuous Short Chain reductase Spm14
Descriptor: Spm14
Authors:Jing, L.Q, Peng, M, Chen, Y.Y, Ju, J.H, Wu, D.L.
Deposit date:2024-10-24
Release date:2025-02-12
Method:X-RAY DIFFRACTION (3.3 Å)
Cite:Biosynthesis of Spiromarmycin Reveals the Unusual Formation of Benzopyran and the Mechanistic Insight of a Promiscuous Short Chain reductase Spm14
To Be Published
9K8R
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BU of 9k8r by Molmil
Structure of Promiscuous short chain dehydrogenase Spm14 in complex with NADPH
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Spm14
Authors:Jing, L.Q, Peng, M, Chen, Y.Y, Ju, J.H, Wu, D.L.
Deposit date:2024-10-24
Release date:2025-02-12
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Biosynthesis of Spiromarmycin Reveals the Unusual Formation of Benzopyran and the Mechanistic Insight of a Promiscuous Short Chain reductase Spm14
to be published
2M0U
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BU of 2m0u by Molmil
Complex structure of C-terminal CFTR peptide and extended PDZ1 domain from NHERF1
Descriptor: C-terminal CFTR peptide, Na(+)/H(+) exchange regulatory cofactor NHE-RF1
Authors:Bhattacharya, S, Ju, J.H, Cowburn, D, Bu, Z.
Deposit date:2012-11-06
Release date:2013-04-24
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Ligand-Induced Dynamic Changes in Extended PDZ Domains from NHERF1.
J.Mol.Biol., 425, 2013
2M0V
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BU of 2m0v by Molmil
Complex structure of C-terminal CFTR peptide and extended PDZ2 domain from NHERF1
Descriptor: C-terminal CFTR peptide, Na(+)/H(+) exchange regulatory cofactor NHE-RF1
Authors:Bhattacharya, S, Ju, J.H, Cowburn, D, Bu, Z.
Deposit date:2012-11-06
Release date:2013-04-24
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Ligand-Induced Dynamic Changes in Extended PDZ Domains from NHERF1.
J.Mol.Biol., 425, 2013
2M0T
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BU of 2m0t by Molmil
Structural characterization of the extended PDZ1 domain from NHERF1
Descriptor: Na(+)/H(+) exchange regulatory cofactor NHE-RF1
Authors:Bhattacharya, S, Ju, J.H, Cowburn, D, Bu, Z.
Deposit date:2012-11-06
Release date:2013-04-24
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Ligand-Induced Dynamic Changes in Extended PDZ Domains from NHERF1.
J.Mol.Biol., 425, 2013
8V3A
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BU of 8v3a by Molmil
Crystal structure of KRAS-G12C (GDP-bound) in complex with BBO-8520
Descriptor: BBO-8520 (bound form), GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ...
Authors:Chan, A.H, Bratcher, D.R, Simanshu, D.K.
Deposit date:2023-11-27
Release date:2024-12-18
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Discovery of BBO-8520, a First-In-Class Direct and Covalent Dual Inhibitor of GTP-Bound (ON) and GDP-Bound (OFF) KRASG12C.
Cancer Discov, 15, 2025
8V39
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BU of 8v39 by Molmil
Crystal structure of active KRAS-G12C (GMPPNP-bound) in complex with BBO-8520
Descriptor: BBO-8520 (bound form), GTPase KRas, MAGNESIUM ION, ...
Authors:Chan, A.H, Ashraf, M, Dharmaiah, S, Simanshu, D.K.
Deposit date:2023-11-27
Release date:2024-12-18
Last modified:2025-03-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Discovery of BBO-8520, a First-In-Class Direct and Covalent Dual Inhibitor of GTP-Bound (ON) and GDP-Bound (OFF) KRASG12C.
Cancer Discov, 15, 2025
7YUA
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BU of 7yua by Molmil
Structural Insight into a Metal-Dependent Mutase MtdL Revealing an Arginine Residue Covalently Mediated Interconversion between Nucleotide-Based furanose and pyranose
Descriptor: GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, SULFATE ION, ...
Authors:Chi, C.B, Ma, M.
Deposit date:2022-08-16
Release date:2023-07-26
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural Insight into a Metal-Dependent Mutase Revealing an Arginine Residue-Covalently Mediated Interconversion between Nucleotide-Based Pyranose and Furanose.
Acs Catalysis, 13, 2023
7YV0
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BU of 7yv0 by Molmil
Structural Insight into a Metal-Dependent Mutase MtdL Revealing an Arginine Residue Covalently Mediated Interconversion between Nucleotide-Based furanose and pyranose
Descriptor: SULFATE ION, Transglycosylse
Authors:Chi, C.B, Ma, M.
Deposit date:2022-08-18
Release date:2023-07-26
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Structural Insight into a Metal-Dependent Mutase Revealing an Arginine Residue-Covalently Mediated Interconversion between Nucleotide-Based Pyranose and Furanose.
Acs Catalysis, 13, 2023

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PDB entries from 2025-06-11

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