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5C31
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BU of 5c31 by Molmil
Constitutively active Sin recombinase catalytic domain reveals two rotational intermediates
Descriptor: SULFATE ION, Sin, putative plasmid resolvase dimer
Authors:Trejo, C.S, Rice, P.A.
Deposit date:2015-06-16
Release date:2016-12-21
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Snapshots of a molecular swivel in action
Nucleic Acids Res., 2018
5C35
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BU of 5c35 by Molmil
Constitutively active Sin recombinase cataltyic domain - T77II100T/Q115R
Descriptor: Recombinase Sin, SULFATE ION
Authors:Trejo, C.S, Rice, P.A.
Deposit date:2015-06-16
Release date:2016-12-21
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Snapshots of a molecular swivel in action
Nucleic Acids Res., 2018
5CE4
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BU of 5ce4 by Molmil
High Resolution X-Ray and Neutron diffraction structure of H-FABP
Descriptor: Fatty acid-binding protein, heart, OLEIC ACID
Authors:Podjarny, A.D, Howard, E.I, Blakeley, M.P, Guillot, B.
Deposit date:2015-07-06
Release date:2016-03-09
Last modified:2024-05-08
Method:NEUTRON DIFFRACTION (0.98 Å), X-RAY DIFFRACTION
Cite:High-resolution neutron and X-ray diffraction room-temperature studies of an H-FABP-oleic acid complex: study of the internal water cluster and ligand binding by a transferred multipolar electron-density distribution.
Iucrj, 3, 2016
1HLB
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BU of 1hlb by Molmil
Structural analysis of monomeric hemichrome and dimeric cyanomet hemoglobins from Caudina arenicola
Descriptor: HEMOGLOBIN (DEOXY), PROTOPORPHYRIN IX CONTAINING FE
Authors:Hackert, M.L, Mitchell, D.T.
Deposit date:1994-03-22
Release date:1994-06-22
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural analysis of monomeric hemichrome and dimeric cyanomet hemoglobins from Caudina arenicola.
J.Mol.Biol., 251, 1995
1KTQ
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BU of 1ktq by Molmil
DNA POLYMERASE
Descriptor: DNA POLYMERASE I
Authors:Korolev, S, Waksman, G.
Deposit date:1995-08-16
Release date:1996-11-08
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structure of the large fragment of Thermus aquaticus DNA polymerase I at 2.5-A resolution: structural basis for thermostability.
Proc.Natl.Acad.Sci.USA, 92, 1995
3HDK
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BU of 3hdk by Molmil
Crystal structure of chemically synthesized [Aib51/51']HIV-1 protease
Descriptor: N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide, [Aib51/51']HIV-1 protease
Authors:Torbeev, V.Y, Kent, S.B.H.
Deposit date:2009-05-07
Release date:2010-04-28
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Protein conformational dynamics in the mechanism of HIV-1 protease catalysis.
Proc.Natl.Acad.Sci.USA, 108, 2011
3IAW
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BU of 3iaw by Molmil
Crystal structure of a chemically synthesized 203 amino acid 'covalent dimer' [Gly51;Aib51']HIV-1 protease molecule complexed with MVT-101 reduced isostere inhibitor at 1.6 A resolution
Descriptor: N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide, SULFATE ION, [Gly51;Aib51'] 'covalent dimer' HIV-1 protease
Authors:Torbeev, V.Y, Kent, S.B.H.
Deposit date:2009-07-14
Release date:2011-04-27
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.61 Å)
Cite:Protein conformational dynamics in the mechanism of HIV-1 protease catalysis.
Proc.Natl.Acad.Sci.USA, 108, 2011
3INT
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BU of 3int by Molmil
Structure of UDP-galactopyranose mutase bound to UDP-galactose (reduced)
Descriptor: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, GALACTOSE-URIDINE-5'-DIPHOSPHATE, Probable UDP-galactopyranose mutase, ...
Authors:Gruber, T.D, Kiessling, L.L, Forest, K.T.
Deposit date:2009-08-12
Release date:2009-09-22
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:X-ray crystallography reveals a reduced substrate complex of UDP-galactopyranose mutase poised for covalent catalysis by flavin .
Biochemistry, 48, 2009
3IMX
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BU of 3imx by Molmil
Crystal Structure of human glucokinase in complex with a synthetic activator
Descriptor: (2R)-3-cyclopentyl-N-(5-methoxy[1,3]thiazolo[5,4-b]pyridin-2-yl)-2-{4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}propanamide, Glucokinase, SODIUM ION, ...
Authors:Stams, T, Vash, B.
Deposit date:2009-08-11
Release date:2009-10-06
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:Investigation of functionally liver selective glucokinase activators for the treatment of type 2 diabetes.
J.Med.Chem., 52, 2009
3GGX
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BU of 3ggx by Molmil
HIV Protease, pseudo-symmetric inhibitors
Descriptor: V-1 protease, methyl [(1S)-1-{[(1R,3S,4S)-4-{[(2S)-3,3-dimethyl-2-{3-[(6-methylpyridin-2-yl)methyl]-2-oxo-2,3-dihydro-1H-imidazol-1-yl}butanoyl]amino}-3-hydroxy-5-phenyl-1-(4-pyridin-2-ylbenzyl)pentyl]carbamoyl}-2,2-dimethylpropyl]carbamate
Authors:Stoll, V.S.
Deposit date:2009-03-02
Release date:2009-05-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:2-Pyridyl P1'-substituted symmetry-based human immunodeficiency virus protease inhibitors (A-792611 and A-790742) with potential for convenient dosing and reduced side effects.
J.Med.Chem., 52, 2009
3FRS
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BU of 3frs by Molmil
Structure of human IST1(NTD) (residues 1-189)(p43212)
Descriptor: GLYCEROL, Uncharacterized protein KIAA0174
Authors:Schubert, H.L, Hill, C.P, Bajorek, M, Sundquist, W.I.
Deposit date:2009-01-08
Release date:2009-06-30
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Structural basis for ESCRT-III protein autoinhibition.
Nat.Struct.Mol.Biol., 16, 2009
8YZD
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BU of 8yzd by Molmil
Structure of JN.1 RBD protein in complex with ACE2.
Descriptor: Angiotensin-converting enzyme 2, Spike glycoprotein,Fibritin,fusion protein
Authors:Wang, Y.J, Zhang, X, Sun, L.
Deposit date:2024-04-06
Release date:2025-01-22
Method:ELECTRON MICROSCOPY (3.07 Å)
Cite:Lineage-specific pathogenicity, immune evasion, and virological features of SARS-CoV-2 BA.2.86/JN.1 and EG.5.1/HK.3.
Nat Commun, 15, 2024
8YZE
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BU of 8yze by Molmil
The JN.1 spike protein (S) in complex with ACE2.
Descriptor: Angiotensin-converting enzyme 2, Spike glycoprotein,Fibritin,Expression Tag
Authors:Wang, Y.J, Zhang, X, Sun, L.
Deposit date:2024-04-06
Release date:2025-01-22
Method:ELECTRON MICROSCOPY (3.06 Å)
Cite:Lineage-specific pathogenicity, immune evasion, and virological features of SARS-CoV-2 BA.2.86/JN.1 and EG.5.1/HK.3.
Nat Commun, 15, 2024
8YZC
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BU of 8yzc by Molmil
Structure of BA.2.86 spike protein in complex with ACE2.
Descriptor: Angiotensin-converting enzyme 2, Spike glycoprotein,Fibritin,Expression Tag
Authors:Wang, Y.J, Zang, X, Sun, L.
Deposit date:2024-04-06
Release date:2025-01-22
Method:ELECTRON MICROSCOPY (2.7 Å)
Cite:Lineage-specific pathogenicity, immune evasion, and virological features of SARS-CoV-2 BA.2.86/JN.1 and EG.5.1/HK.3.
Nat Commun, 15, 2024
8YZB
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BU of 8yzb by Molmil
BA.2.86 RBD protein in complex with ACE2.
Descriptor: Angiotensin-converting enzyme 2, Spike glycoprotein,Fibritin,fusion protein
Authors:Wang, Y.J, Zhang, X, Sun, L.
Deposit date:2024-04-06
Release date:2025-01-22
Method:ELECTRON MICROSCOPY (3.29 Å)
Cite:Lineage-specific pathogenicity, immune evasion, and virological features of SARS-CoV-2 BA.2.86/JN.1 and EG.5.1/HK.3.
Nat Commun, 15, 2024
3FRV
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BU of 3frv by Molmil
Structure of Human CHMP3 (residues 1-150)
Descriptor: Charged multivesicular body protein 3
Authors:Hill, C.P, Schubert, H.L, McCullough, J, Sundquist, W.I.
Deposit date:2009-01-08
Release date:2009-06-30
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (3.7 Å)
Cite:Structural basis for ESCRT-III protein autoinhibition.
Nat.Struct.Mol.Biol., 16, 2009
5ZRT
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BU of 5zrt by Molmil
Crystal structure of human C1ORF123 protein
Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, GLYCEROL, ...
Authors:Rahaman, S.N.A, Yusop, J.M, Mohamed-Hussein, Z.A, Wan Mohd, A, Ho, K.L, Teh, A.H, Waterman, J, Ng, C.L.
Deposit date:2018-04-25
Release date:2018-08-01
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure and functional analysis of human C1ORF123.
Peerj, 6, 2018
8YWD
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BU of 8ywd by Molmil
Crystal structure of trehalose synthase mutant N253C from Deinococcus radiodurans
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, MAGNESIUM ION, ...
Authors:Ye, L.C, Chen, S.C.
Deposit date:2024-03-30
Release date:2025-03-19
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Structural and Mutational Analyses of Trehalose Synthase from Deinococcus radiodurans Reveal the Interconversion of Maltose-Trehalose Mechanism.
J.Agric.Food Chem., 72, 2024
3INR
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BU of 3inr by Molmil
Structure of UDP-galactopyranose mutase bound to UDP-galactose (oxidized)
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, GALACTOSE-URIDINE-5'-DIPHOSPHATE, UDP-galactopyranose mutase
Authors:Gruber, T.D, Kiessling, L.L, Forest, K.T.
Deposit date:2009-08-12
Release date:2009-09-22
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:X-ray crystallography reveals a reduced substrate complex of UDP-galactopyranose mutase poised for covalent catalysis by flavin .
Biochemistry, 48, 2009
3GF4
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BU of 3gf4 by Molmil
Structure of UDP-galactopyranose mutase bound to UDP-glucose
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, UDP-galactopyranose mutase, URIDINE-5'-DIPHOSPHATE-GLUCOSE, ...
Authors:Gruber, T.D, Borrok, M.J, Kiessling, L.L, Forest, K.T.
Deposit date:2009-02-26
Release date:2009-06-09
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Ligand binding and substrate discrimination by UDP-galactopyranose mutase.
J.Mol.Biol., 391, 2009
3HLO
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BU of 3hlo by Molmil
Crystal structure of chemically synthesized 'covalent dimer' [Gly51/D-Ala51']HIV-1 protease
Descriptor: 'covalent dimer' [Gly51/D-Ala51'] HIV-1 protease, N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide
Authors:Torbeev, V.Y, Kent, S.B.H.
Deposit date:2009-05-27
Release date:2011-07-27
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Protein conformational dynamics in the mechanism of HIV-1 protease catalysis.
Proc.Natl.Acad.Sci.USA, 108, 2011
6ABH
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BU of 6abh by Molmil
Structure of a natural red emitting luciferase from Phrixothrix hirtus (P1 crystal form)
Descriptor: Red-bioluminescence eliciting luciferase
Authors:Carrasco-Lopez, C, Panjikar, S, Naumov, P, Rabeh, W.
Deposit date:2018-07-21
Release date:2018-08-22
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:Beetle luciferases with naturally red- and blue-shifted emission.
Life Sci Alliance, 1, 2018
3GGA
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BU of 3gga by Molmil
HIV Protease inhibitors with pseudo-symmetric cores
Descriptor: V-1 protease, methyl [(1S,4S,5S,7S,10S)-4-benzyl-1,10-di-tert-butyl-5-hydroxy-2,9,12-trioxo-7-(4-pyridin-2-ylbenzyl)-13-oxa-3,8,11-triazatetradec-1-yl]carbamate
Authors:Stoll, V.S.
Deposit date:2009-02-27
Release date:2009-05-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:2-Pyridyl P1'-substituted symmetry-based human immunodeficiency virus protease inhibitors (A-792611 and A-790742) with potential for convenient dosing and reduced side effects.
J.Med.Chem., 52, 2009
8Z2L
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BU of 8z2l by Molmil
Crystal structure of trehalose synthase mutant N253E from Deinococcus radiodurans
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, MAGNESIUM ION, ...
Authors:Ye, L.C, Chen, S.C.
Deposit date:2024-04-12
Release date:2025-01-01
Method:X-RAY DIFFRACTION (3.04 Å)
Cite:Structural and Mutational Analyses of Trehalose Synthase from Deinococcus radiodurans Reveal the Interconversion of Maltose-Trehalose Mechanism.
J.Agric.Food Chem., 72, 2024
8Z2Q
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BU of 8z2q by Molmil
Crystal structure of trehalose synthase mutant N253Q from Deinococcus radiodurans
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, MAGNESIUM ION, ...
Authors:Ye, L.C, Chen, S.C.
Deposit date:2024-04-13
Release date:2025-01-01
Method:X-RAY DIFFRACTION (2.99 Å)
Cite:Structural and Mutational Analyses of Trehalose Synthase from Deinococcus radiodurans Reveal the Interconversion of Maltose-Trehalose Mechanism.
J.Agric.Food Chem., 72, 2024

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数据于2025-07-09公开中

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