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8H17
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BU of 8h17 by Molmil
Crystal structure of the Globin domain of Thermosynechococcus elongatus BP-1
Descriptor: IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE, Tlr1989 protein
Authors:Mathur, S, Yadav, S.K, Pal, K.R, Kundu, S.
Deposit date:2022-09-30
Release date:2023-04-26
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:A novel single sensor hemoglobin domain from the thermophilic cyanobacteria Thermosynechococcus elongatus BP-1 exhibits higher pH but lower thermal stability compared to globins from mesophilic organisms.
Int.J.Biol.Macromol., 240, 2023
4L7Y
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BU of 4l7y by Molmil
Deoxygenated Hb in complex with the allosteric effectors, IRL2500 and 2,3-DPG
Descriptor: (2R)-2,3-diphosphoglyceric acid, (2R)-2-({(2S)-3-(biphenyl-4-yl)-2-[(3,5-dimethylbenzoyl)(methyl)amino]propanoyl}amino)-3-(1H-indol-3-yl)propanoic acid (non-preferred name), Hemoglobin subunit alpha, ...
Authors:Safo, M.K, Chowdhury, N.
Deposit date:2013-06-14
Release date:2013-07-03
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Novel small molecule modulators of human hemoglobin oxygen binding identified by small molecule microarray screening
To be Published
7XLI
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BU of 7xli by Molmil
Crystal structure of IsdB linker-NEAT2 bound to a nanobody (VHH)
Descriptor: CALCIUM ION, CHLORIDE ION, Iron-regulated surface determinant protein B, ...
Authors:Caaveiro, J.M.M, Valenciano-Bellido, S, Tsumoto, K.
Deposit date:2022-04-21
Release date:2023-05-31
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Targeting hemoglobin receptors IsdH and IsdB of Staphylococcus aureus with a single VHH antibody inhibits bacterial growth.
J.Biol.Chem., 299, 2023
7XLD
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BU of 7xld by Molmil
Crystal structure of IsdH linker-NEAT3 bound to a nanobody (VHH)
Descriptor: Iron-regulated surface determinant protein H, MAGNESIUM ION, Nanobody VHH6, ...
Authors:Caaveiro, J.M.M, Valenciano-Bellido, S, Tsumoto, K.
Deposit date:2022-04-21
Release date:2023-05-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Targeting hemoglobin receptors IsdH and IsdB of Staphylococcus aureus with a single VHH antibody inhibits bacterial growth.
J.Biol.Chem., 299, 2023
5D1V
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BU of 5d1v by Molmil
Crystal Structure and Thermal Stability of Hemoglobin from Thermophilic Phototrophic Bacterium Chloroflexus aurantiacus
Descriptor: Globin, PROTOPORPHYRIN IX CONTAINING FE
Authors:Fromme, R, Holl, M, Tang, J.K.
Deposit date:2015-08-04
Release date:2016-08-10
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Crystal Structure and Thermal Stability of Hemoglobin from Thermophilic Phototrophic Bacterium Chloroflexus aurantiacus
To Be Published
5CHQ
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BU of 5chq by Molmil
Dehaloperoxidase B in complex with substrate p-nitrophenol
Descriptor: Dehaloperoxidase B, GLYCEROL, P-NITROPHENOL, ...
Authors:Carey, L, Ghiladi, R.
Deposit date:2015-07-10
Release date:2016-04-27
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Nonmicrobial Nitrophenol Degradation via Peroxygenase Activity of Dehaloperoxidase-Hemoglobin from Amphitrite ornata.
Biochemistry, 55, 2016
5CHR
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BU of 5chr by Molmil
Dehaloperoxidase B in complex with substrate p-nitrocatechol
Descriptor: 4-NITROCATECHOL, Dehaloperoxidase B, GLYCEROL, ...
Authors:Carey, L, Ghiladi, R.
Deposit date:2015-07-10
Release date:2016-04-27
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Nonmicrobial Nitrophenol Degradation via Peroxygenase Activity of Dehaloperoxidase-Hemoglobin from Amphitrite ornata.
Biochemistry, 55, 2016
2W6W
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BU of 2w6w by Molmil
Crystal structure of recombinant Sperm Whale Myoglobin under 1atm of Xenon
Descriptor: GLYCEROL, MYOGLOBIN, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Miele, A.E, Draghi, F, Renzi, F, Sciara, G, Johnson, K.A, Vallone, B, Brunori, M, Savino, C.
Deposit date:2008-12-19
Release date:2009-04-28
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Pattern of Cavities in Globins: The Case of Human Hemoglobin.
Biopolymers, 91, 2009
4ESA
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BU of 4esa by Molmil
X-ray structure of carbonmonoxy hemoglobin of Eleginops maclovinus
Descriptor: CARBON MONOXIDE, GLYCEROL, Hemoglobin alpha chain, ...
Authors:Merlino, A, Vitagliano, L, Mazzarella, L, Vergara, A.
Deposit date:2012-04-23
Release date:2012-11-07
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:ATP regulation of the ligand-binding properties in temperate and cold-adapted haemoglobins. X-ray structure and ligand-binding kinetics in the sub-Antarctic fish Eleginops maclovinus.
Mol Biosyst, 8, 2012
3MOU
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BU of 3mou by Molmil
Characterization of the Inhibitor Binding Site of the Dehaloperoxidase-Hemoglobin from Amphitrite ornata using High-Pressure Xenon Derivatization
Descriptor: Dehaloperoxidase A, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION, ...
Authors:de Serrano, V.S, Franzen, S.
Deposit date:2010-04-23
Release date:2011-04-20
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.711 Å)
Cite:Characterization of the Inhibitor Binding Site of the Dehaloperoxidase-Hemoglobin from Amphitrite ornata using High-Pressure Xenon Derivatization
To be Published
6E3D
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BU of 6e3d by Molmil
Atomic structure of Mycobacterium tuberculosis DppA
Descriptor: Periplasmic dipeptide-binding lipoprotein DPPA, tetra-peptide picked up from the expression host
Authors:Ko, Y, Mitra, A, Niederweis, M, Cingolani, G.
Deposit date:2018-07-13
Release date:2019-09-11
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.271 Å)
Cite:Heme and hemoglobin utilization by Mycobacterium tuberculosis.
Nat Commun, 10, 2019
6E4D
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BU of 6e4d by Molmil
Atomic structure of Mycobacterium tuberculosis DppA
Descriptor: Periplasmic dipeptide-binding lipoprotein DPPA, VAL-VAL-VAL-ALA
Authors:Ko, Y, Mitra, A, Niederweis, M, Cingolani, G.
Deposit date:2018-07-17
Release date:2019-09-11
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.252 Å)
Cite:Heme and hemoglobin utilization by Mycobacterium tuberculosis.
Nat Commun, 10, 2019
2AV3
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BU of 2av3 by Molmil
F97L- no ligand
Descriptor: Globin I, PROTOPORPHYRIN IX CONTAINING FE
Authors:Knapp, J.E, Bonham, M.A, Gibson, Q.H, Nichols, J.C, Royer Jr, W.E.
Deposit date:2005-08-29
Release date:2006-03-28
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Residue F4 plays a key role in modulating oxygen affinity and cooperativity in Scapharca dimeric hemoglobin
Biochemistry, 44, 2005
4NLA
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BU of 4nla by Molmil
Structure of the central NEAT domain, N2, of the listerial Hbp2 protein, apo form
Descriptor: Iron-regulated surface determinant protein A, SULFATE ION
Authors:Malmirchegini, G.R, Sawaya, M.R, Clubb, R.T.
Deposit date:2013-11-14
Release date:2014-10-22
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Novel Mechanism of Hemin Capture by Hbp2, the Hemoglobin-binding Hemophore from Listeria monocytogenes.
J.Biol.Chem., 289, 2014
3ELL
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BU of 3ell by Molmil
Structure of the hemophore from Pseudomonas aeruginosa (HasAp)
Descriptor: HasAp (Heme acquisition protein HasAp), PROTOPORPHYRIN IX CONTAINING FE
Authors:Schonbrunn, E, Rivera, M.
Deposit date:2008-09-22
Release date:2009-01-20
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural characterization of the hemophore HasAp from Pseudomonas aeruginosa: NMR spectroscopy reveals protein-protein interactions between Holo-HasAp and hemoglobin.
Biochemistry, 48, 2009
4MYP
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BU of 4myp by Molmil
Structure of the central NEAT domain, N2, of the listerial Hbp2 protein complexed with heme
Descriptor: GLYCEROL, Iron-regulated surface determinant protein A, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Malmirchegini, G.R, Sawaya, M.R, Clubb, R.T.
Deposit date:2013-09-27
Release date:2014-10-22
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Novel Mechanism of Hemin Capture by Hbp2, the Hemoglobin-binding Hemophore from Listeria monocytogenes.
J.Biol.Chem., 289, 2014
4HSW
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BU of 4hsw by Molmil
Structure of the L100F mutant of dehaloperoxidase-hemoglobin A from Amphitrite ornata
Descriptor: Dehaloperoxidase A, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Thompson, M.K, Plummer, A, Franzen, S.
Deposit date:2012-10-31
Release date:2013-05-01
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.22 Å)
Cite:Role of polarity of the distal pocket in the control of inhibitor binding in dehaloperoxidase-hemoglobin.
Biochemistry, 52, 2013
2AV0
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BU of 2av0 by Molmil
F97L with CO bound
Descriptor: CARBON MONOXIDE, Globin I, PROTOPORPHYRIN IX CONTAINING FE
Authors:Knapp, J.E, Bonham, M.A, Gibson, Q.H, Nichols, J.C, Royer Jr, W.E.
Deposit date:2005-08-29
Release date:2006-03-28
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Residue F4 plays a key role in modulating oxygen affinity and cooperativity in Scapharca dimeric hemoglobin
Biochemistry, 44, 2005
8FDJ
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BU of 8fdj by Molmil
Wild-Type Sperm Whale Myoglobin in Complex with Nitrosobenzene
Descriptor: Myoglobin, NITROSOBENZENE, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Powell, S.M, Wang, B, Thomas, L.M, Richter-Addo, G.B.
Deposit date:2022-12-03
Release date:2023-07-12
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Crystal structural investigations of heme protein derivatives resulting from reactions of aryl- and alkylhydroxylamines with human hemoglobin.
J.Inorg.Biochem., 246, 2023
4DWU
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BU of 4dwu by Molmil
Carbonmonoxy dehaloperoxidase-hemoglobin A structure at 1.44 Angstrom resolution
Descriptor: CARBON MONOXIDE, Dehaloperoxidase A, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:de Serrano, V.S, Zhao, J, Franzen, S.
Deposit date:2012-02-26
Release date:2013-02-27
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:A unique role for the distal histidine observed in carbonmonoxy dehaloperoxidase-hemoglobin A structures
To be Published
1O1I
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BU of 1o1i by Molmil
Cyanomet hemoglobin (A-GLY-C:V1M,L29F,H58Q; B,D:V1M,L106W)
Descriptor: CYANIDE ION, Hemoglobin Alpha chain, Hemoglobin Beta chain, ...
Authors:Brucker, E.A.
Deposit date:2002-11-19
Release date:2002-12-18
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:

4KJT
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BU of 4kjt by Molmil
Structure of the L100F MUTANT OF DEHALOPEROXIDASE-HEMOGLOBIN A FROM AMPHITRITE ORNATA WITH OXYGEN
Descriptor: 1,2-ETHANEDIOL, Dehaloperoxidase A, OXYGEN MOLECULE, ...
Authors:Wang, C, Lovelace, L, Lebioda, L.
Deposit date:2013-05-03
Release date:2014-03-26
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:Influence of heme environment structure on dioxygen affinity for the dual function Amphitrite ornata hemoglobin/dehaloperoxidase. Insights into the evolutional structure-function adaptations.
Arch.Biochem.Biophys., 545, 2014
1NEJ
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BU of 1nej by Molmil
Crystalline Human Carbonmonoxy Hemoglobin S (Liganded Sickle Cell Hemoglobin) Exhibits The R2 Quaternary State At Neutral pH In The Presence Of Polyethylene Glycol: The 2.1 Angstrom Resolution Crystal Structure
Descriptor: CARBON MONOXIDE, Hemoglobin alpha chain, Hemoglobin beta chain, ...
Authors:Patskovska, L.N, Patskovsky, Y.V, Almo, S.C, Hirsch, R.E.
Deposit date:2002-12-11
Release date:2003-12-16
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:COHbC and COHbS crystallize in the R2 quaternary state at neutral pH in the presence of PEG 4000.
Acta Crystallogr.,Sect.D, 61, 2005
7UD8
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BU of 7ud8 by Molmil
Crystal structure of carbon monoxy Hemoglobin in complex with 5HMF at 1.8 Angstrom
Descriptor: (5-methylfuran-2-yl)methanol, Hemoglobin subunit alpha, Hemoglobin subunit beta, ...
Authors:Donkor, A.K, Musayev, F.N, Safo, M.S.
Deposit date:2022-03-18
Release date:2022-03-30
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Design, Synthesis, and Antisickling Investigation of a Nitric Oxide-Releasing Prodrug of 5HMF for the Treatment of Sickle Cell Disease.
Biomolecules, 12, 2022
3NML
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BU of 3nml by Molmil
Sperm whale myoglobin mutant H64W carbonmonoxy-form
Descriptor: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Birukou, I, Soman, J, Olson, J.S.
Deposit date:2010-06-22
Release date:2010-07-14
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Blocking the gate to ligand entry in human hemoglobin.
J.Biol.Chem., 286, 2011

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PDB entries from 2024-10-09

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