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Crystal structure of Anti-Heroin Antibody HY4-1F9 Fab Complexed with Morphine
Descriptor:	(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-E]ISOQUINOLINE-7,9-DIOL, ACETATE ION, HY4-1F9 Fab Heavy Chain, ...
Authors:	Rodarte, J.V, Pancera, M.P.
Deposit date:	2022-03-03
Release date:	2023-01-11
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.82 Å)
Cite:	Structures of drug-specific monoclonal antibodies bound to opioids and nicotine reveal a common mode of binding. Structure, 31, 2023

7U61

Crystal Structure of Anti-Nicotine Antibody NIC311 Fab Complexed with Nicotine
Descriptor:	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE, NIC311 Fab Heavy Chain, NIC311 Fab Light Chain, ...
Authors:	Rodarte, J.V, Pancera, M.P, Liban, T.L.
Deposit date:	2022-03-03
Release date:	2023-01-11
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	Structures of drug-specific monoclonal antibodies bound to opioids and nicotine reveal a common mode of binding. Structure, 31, 2023

7U64

Crystal Structure of Anti-Fentanyl Antibody HY6-F9.6 Fab Complexed with Fentanyl
Descriptor:	ACETATE ION, HY6-F9.6 Fab heavy chain, HY6-F9.6 Fab light chain, ...
Authors:	Rodarte, J.V, Pancera, M.P.
Deposit date:	2022-03-03
Release date:	2023-01-11
Last modified:	2023-10-25
Method:	X-RAY DIFFRACTION (1.75 Å)
Cite:	Structures of drug-specific monoclonal antibodies bound to opioids and nicotine reveal a common mode of binding. Structure, 31, 2023

1IGI

26-10 FAB:DIGOXIN COMPLEX-AFFINITY AND SPECIFICITY DUE TO SURFACE COMPLEMENTARITY
Descriptor:	IGG2A-KAPPA 26-10 FAB (HEAVY CHAIN), IGG2A-KAPPA 26-10 FAB (LIGHT CHAIN)
Authors:	Jeffrey, P.D, Sheriff, S.
Deposit date:	1993-02-19
Release date:	1993-04-15
Last modified:	2011-07-13
Method:	X-RAY DIFFRACTION (2.7 Å)
Cite:	26-10 Fab-digoxin complex: affinity and specificity due to surface complementarity. Proc.Natl.Acad.Sci.USA, 90, 1993

1IGJ

26-10 FAB:DIGOXIN COMPLEX-AFFINITY AND SPECIFICITY DUE TO SURFACE COMPLEMENTARITY
Descriptor:	DIGOXIN, IGG2A-KAPPA 26-10 FAB (HEAVY CHAIN), IGG2A-KAPPA 26-10 FAB (LIGHT CHAIN)
Authors:	Jeffrey, P.D, Sheriff, S.
Deposit date:	1993-02-19
Release date:	1993-04-15
Last modified:	2011-07-13
Method:	X-RAY DIFFRACTION (2.5 Å)
Cite:	26-10 Fab-digoxin complex: affinity and specificity due to surface complementarity. Proc.Natl.Acad.Sci.USA, 90, 1993

3PEC

Siderocalin Recognitin of Carboxymycobactins: Interference by the immune system in intracellular iron acquisition by Mycobacteria tuberculosis
Descriptor:	9-{hydroxy[(5S,6R)-6-hydroxy-6-{[(1S)-3-{[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino}-1-methyl-3-oxopropyl]oxy}-5-({[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]carbonyl}amino)hexyl]amino}-9-oxononanoic acid, FE (III) ION, GLYCEROL, ...
Authors:	Clifton, M.C.
Deposit date:	2010-10-25
Release date:	2011-10-05
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.19 Å)
Cite:	Siderocalin Recognitin of Carboxymycobactins: Interference by the immune system in intracellular iron acquisition by Mycobacteria tuberculosis To be Published

3PED

Siderocalin Recognitin of Carboxymycobactins: Interference by the immune system in intracellular iron acquisition by Mycobacteria tuberculosis
Descriptor:	(9Z)-11-{hydroxy[(5S)-6-{[(1S)-3-{[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino}-1-methyl-3-oxopropyl]oxy}-5-({[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]carbonyl}amino)-6-oxohexyl]amino}-11-oxoundec-9-enoic acid, FE (III) ION, Neutrophil gelatinase-associated lipocalin, ...
Authors:	Clifton, M.C.
Deposit date:	2010-10-25
Release date:	2011-10-05
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Siderocalin Recognitin of Carboxymycobactins: Interference by the immune system in intracellular iron acquisition by Mycobacteria tuberculosis To be Published

3RPT

Crystal structure of the anti-HIV b12 scaffold protein
Descriptor:	Endoglucanase E-2, SULFATE ION
Authors:	Chen, L, Kwong, P.D.
Deposit date:	2011-04-27
Release date:	2011-12-21
Last modified:	2017-07-26
Method:	X-RAY DIFFRACTION (1.303 Å)
Cite:	Computation-guided backbone grafting of a discontinuous motif onto a protein scaffold. Science, 334, 2011

3T1D

The mutant structure of human Siderocalin W79A, R81A, Y106F bound to Enterobactin
Descriptor:	2,3-DIHYDROXY-BENZOIC ACID, 2-(2,3-DIHYDROXY-BENZOYLAMINO)-3-HYDROXY-PROPIONIC ACID, CHLORIDE ION, ...
Authors:	Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:	2011-07-21
Release date:	2011-08-17
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Parsing the functional specificity of Siderocalin/Lipocalin 2/NGAL for siderophores and related small-molecule ligands. J Struct Biol X, 2, 2019

3TF6

Crystal structure of Neutrophil gelatinase-associated lipocalin (C87S mutant) in complex with Europium and the siderophore analog tren(cam)(1,2-hopo)2
Descriptor:	2,3-DIHYDROXY-BENZOIC ACID, CHLORIDE ION, EUROPIUM ION, ...
Authors:	Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:	2011-08-15
Release date:	2011-09-07
Last modified:	2019-02-13
Method:	X-RAY DIFFRACTION (2.35 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be published, 7

3U0D

The structure of human Siderocalin bound to the bacterial siderophore 2,3-DHBA
Descriptor:	2,3-DIHYDROXY-BENZOIC ACID, CHLORIDE ION, FE (III) ION, ...
Authors:	Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:	2011-09-28
Release date:	2011-10-12
Last modified:	2023-09-13
Method:	X-RAY DIFFRACTION (2.51 Å)
Cite:	Siderocalin/Lcn2/NGAL/24p3 does not drive apoptosis through gentisic acid mediated iron withdrawal in hematopoietic cell lines. Plos One, 7, 2012

4ODX

4E10 germline encoded precursor no.7 in complex with epitope scaffold T117
Descriptor:	4E10 epitope scaffold T117, GEP7 Fv heavy chain, GEP7 Fv light chain
Authors:	Finton, K.A.K.
Deposit date:	2014-01-10
Release date:	2014-10-08
Method:	X-RAY DIFFRACTION (3.1 Å)
Cite:	Ontogeny of Recognition Specificity and Functionality for the Broadly Neutralizing Anti-HIV Antibody 4E10. Plos Pathog., 10, 2014

4OB5

Ontogeny of recognition specificity and functionality for the broadly neutralizing anti-HIV antibody 4E10
Descriptor:	4E10 antibody germline precursor 7 heavy chain Fv, 4E10 antibody germline precursor 7 light chain Fv, GLYCEROL, ...
Authors:	Jaffe, J.B, Rupert, P.B.
Deposit date:	2014-01-06
Release date:	2014-10-08
Method:	X-RAY DIFFRACTION (1.7 Å)
Cite:	Ontogeny of Recognition Specificity and Functionality for the Broadly Neutralizing Anti-HIV Antibody 4E10. Plos Pathog., 10, 2014

4M62

Ontogeny of recognition specificity and functionality for the anti-HIV neutralizing antibody 4E10
Descriptor:	GEP2 FV heavy chain, GEP2 FV light chain, SULFATE ION, ...
Authors:	Finton, K.A.K.
Deposit date:	2013-08-08
Release date:	2014-10-08
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Ontogeny of Recognition Specificity and Functionality for the Broadly Neutralizing Anti-HIV Antibody 4E10. Plos Pathog., 10, 2014

4M8Q

Ontogeny of recognition specificity and functionality for the anti-HIV neutralizing antibody 4E10
Descriptor:	4E10 epitope scaffold T117, GEP1 Fv heavy chain, GEP1 Fv light chain
Authors:	Finton, K.A.K.
Deposit date:	2013-08-13
Release date:	2014-10-08
Last modified:	2018-03-07
Method:	X-RAY DIFFRACTION (2.89 Å)
Cite:	Ontogeny of Recognition Specificity and Functionality for the Broadly Neutralizing Anti-HIV Antibody 4E10. Plos Pathog., 10, 2014

4LRN

Ontogeny of recognition specificity and functionality for the anti-HIV antibody 4E10
Descriptor:	GEP 1 heavy chain, GEP 1 light chain
Authors:	Finton, K.A.K.
Deposit date:	2013-07-20
Release date:	2014-10-08
Method:	X-RAY DIFFRACTION (1.89 Å)
Cite:	Ontogeny of Recognition Specificity and Functionality for the Broadly Neutralizing Anti-HIV Antibody 4E10. Plos Pathog., 10, 2014

1MNG

STRUCTURE-FUNCTION IN E. COLI IRON SUPEROXIDE DISMUTASE: COMPARISONS WITH THE MANGANESE ENZYME FROM T. THERMOPHILUS
Descriptor:	AZIDE ION, MANGANESE (II) ION, MANGANESE SUPEROXIDE DISMUTASE
Authors:	Lah, M.S, Dixon, M, Pattridge, K.A, Stallings, W.C, Fee, J.A, Ludwig, M.L.
Deposit date:	1994-07-13
Release date:	1994-10-15
Last modified:	2024-02-14
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Structure-function in Escherichia coli iron superoxide dismutase: comparisons with the manganese enzyme from Thermus thermophilus. Biochemistry, 34, 1995

3H3P

Crystal structure of HIV epitope-scaffold 4E10 Fv complex
Descriptor:	4E10_S0_1TJLC_004_N, CALCIUM ION, Fv 4E10 heavy chain, ...
Authors:	Holmes, M.A.
Deposit date:	2009-04-16
Release date:	2010-01-19
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.7 Å)
Cite:	Interactions between lipids and human anti-HIV antibody 4E10 can be reduced without ablating neutralizing activity J.Virol., 84, 2010

3I0A

Crystal structure of Siderocalin (NGAL, Lipocalin 2) K134A mutant complexed with Ferric Enterobactin
Descriptor:	2,3-DIHYDROXY-BENZOIC ACID, FE (III) ION, GLYCEROL, ...
Authors:	Clifton, M.C.
Deposit date:	2009-06-24
Release date:	2010-06-09
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.6 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be Published

3HWG

Crystal structure of Siderocalin (NGAL, Lipocalin 2) complexed with Fe-TrenCam-hopo2
Descriptor:	CHLORIDE ION, FE (III) ION, GLYCEROL, ...
Authors:	Clifton, M.C.
Deposit date:	2009-06-17
Release date:	2010-06-02
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.19 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be Published

3HWF

Crystal structure of Siderocalin (NGAL, Lipocalin 2) complexed with Fe-TrenCam2-hopo
Descriptor:	CHLORIDE ION, FE (III) ION, GLYCEROL, ...
Authors:	Clifton, M.C.
Deposit date:	2009-06-17
Release date:	2010-06-02
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (3.2 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be Published

3HWD

Crystal structure of Siderocalin (NGAL, Lipocalin 2) K125A-K134A mutant complexed with Ferric Enterobactin
Descriptor:	Neutrophil gelatinase-associated lipocalin, SODIUM ION
Authors:	Clifton, M.C.
Deposit date:	2009-06-17
Release date:	2010-06-02
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.95 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be Published

3HWE

Crystal structure of Siderocalin (NGAL, Lipocalin 2) complexed with Fe-BisHaCam
Descriptor:	FE (III) ION, GLYCEROL, Neutrophil gelatinase-associated lipocalin, ...
Authors:	Clifton, M.C.
Deposit date:	2009-06-17
Release date:	2010-06-02
Last modified:	2023-09-06
Method:	X-RAY DIFFRACTION (2.8 Å)
Cite:	Parsing the functional specificity of Siderocalin / Lipocalin 2 / NGAL for siderophores and related small-molecule ligands To be Published

6ATM

Exploring Cystine Dense Peptide Space to Open a Unique Molecular Toolbox
Descriptor:	Potassium channel toxin alpha-KTx 3.10
Authors:	Gewe, M.M, Rupert, P, Strong, R.K.
Deposit date:	2017-08-29
Release date:	2018-08-22
Last modified:	2019-11-06
Method:	X-RAY DIFFRACTION (2.09 Å)
Cite:	Exploring Cystine Dense Peptide Space to Open a Unique Molecular Toolbox To Be Published

6ATY

Exploring Cystine Dense Peptide Space to Open a Unique Molecular Toolbox
Descriptor:	GLYCEROL, Venom protein 51.1
Authors:	Gewe, M.M, Rupert, P, Strong, R.K.
Deposit date:	2017-08-29
Release date:	2018-08-22
Method:	X-RAY DIFFRACTION (1.8 Å)
Cite:	Exploring Cystine Dense Peptide Space to Open a Unique Molecular Toolbox To Be Published

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