4KY1
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![BU of 4ky1 by Molmil](/molmil-images/mine/4ky1) | humanized HP1/2 Fab | Descriptor: | IMMUNOGLOBULIN IGG1 FAB, HEAVY CHAIN, LIGHT CHAIN | Authors: | Arndt, J.W, Hanf, K.J.M, Lugovskoy, A, Chen, L.L, Jarpe, M, Boriack-Sjodin, A, Li, Y, van Vlijmen, H, Pepinsky, B, Taylor, F, Silvian, L, Taveras, A. | Deposit date: | 2013-05-28 | Release date: | 2013-07-24 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (2.97 Å) | Cite: | Antibody humanization by redesign of complementarity-determining region residues proximate to the acceptor framework. METHODS (SAN DIEGO), 65, 2014
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2Q33
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![BU of 2q33 by Molmil](/molmil-images/mine/2q33) | Crystal structure of all-D monellin at 1.8 A resolution | Descriptor: | D-MONELLIN CHAIN A, D-MONELLIN CHAIN B | Authors: | Hung, L.-W, Kohmura, M, Ariyoshi, Y, Kim, S.-H. | Deposit date: | 2007-05-29 | Release date: | 2007-11-13 | Last modified: | 2017-10-18 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure of an Enantiomeric Protein, D-Monellin at 1.8 A Resolution. Acta Crystallogr.,Sect.D, 54, 1998
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4ZCN
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![BU of 4zcn by Molmil](/molmil-images/mine/4zcn) | Crystal structure of nvPizza2-S16S58 | Descriptor: | IODIDE ION, SULFATE ION, nvPizza2-S16S58 | Authors: | Voet, A.R.D, Noguchi, H, Addy, C, Zhang, K.Y.J, Tame, J.R.H. | Deposit date: | 2015-04-16 | Release date: | 2015-07-01 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.3 Å) | Cite: | Crystal structure of nvPizza2-S16S58 To Be Published
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4KWV
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![BU of 4kwv by Molmil](/molmil-images/mine/4kwv) | Crystal Structure of human apo-QPRT | Descriptor: | Nicotinate-nucleotide pyrophosphorylase [carboxylating] | Authors: | Malik, S.S, Patterson, D.N, Ncube, Z, Toth, E.A. | Deposit date: | 2013-05-24 | Release date: | 2013-10-02 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (2.797 Å) | Cite: | The crystal structure of human quinolinic acid phosphoribosyltransferase in complex with its inhibitor phthalic acid. Proteins, 82, 2014
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3C3H
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![BU of 3c3h by Molmil](/molmil-images/mine/3c3h) | alpha/beta-Peptide helix bundles: A GCN4-pLI analogue with an (alpha-alpha-beta) backbone and cyclic beta residues | Descriptor: | alpha/beta-peptide based on the GCN4-pLI side chain sequence, with an (alpha-alpha-beta) backbone and cyclic beta-residues at positions 1, 4, ... | Authors: | Horne, W.S, Price, J.L, Gellman, S.H. | Deposit date: | 2008-01-28 | Release date: | 2008-06-17 | Last modified: | 2024-07-10 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Interplay among side chain sequence, backbone composition, and residue rigidification in polypeptide folding and assembly. Proc.Natl.Acad.Sci.Usa, 105, 2008
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4LBT
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![BU of 4lbt by Molmil](/molmil-images/mine/4lbt) | Endothiapepsin in complex with 100mM acylhydrazone inhibitor | Descriptor: | (2S)-2-azanyl-3-(3H-indol-3-yl)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]propanamide, DIMETHYL SULFOXIDE, Endothiapepsin, ... | Authors: | Radeva, N, Heine, A, Winquist, J, Klebe, G. | Deposit date: | 2013-06-21 | Release date: | 2014-04-02 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.251 Å) | Cite: | Structure-based design of inhibitors of the aspartic protease endothiapepsin by exploiting dynamic combinatorial chemistry. Angew.Chem.Int.Ed.Engl., 53, 2014
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4LHH
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![BU of 4lhh by Molmil](/molmil-images/mine/4lhh) | Endothiapepsin in complex with 2mM acylhydrazone inhibitor | Descriptor: | (2S)-2-azanyl-3-(3H-indol-3-yl)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]propanamide, ACETATE ION, DIMETHYL SULFOXIDE, ... | Authors: | Radeva, N, Heine, A, Klebe, G. | Deposit date: | 2013-07-01 | Release date: | 2014-04-02 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.73 Å) | Cite: | Structure-based design of inhibitors of the aspartic protease endothiapepsin by exploiting dynamic combinatorial chemistry. Angew.Chem.Int.Ed.Engl., 53, 2014
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4KWW
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![BU of 4kww by Molmil](/molmil-images/mine/4kww) | The crystal structure of human quinolinic acid phosphoribosyltransferase in complex with its inhibitor phthalic acid | Descriptor: | Nicotinate-nucleotide pyrophosphorylase [carboxylating], PHTHALIC ACID | Authors: | Malik, S.S, Dimeka, P.N, Ncube, Z, Toth, E.A. | Deposit date: | 2013-05-24 | Release date: | 2013-10-02 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (2.55 Å) | Cite: | The crystal structure of human quinolinic acid phosphoribosyltransferase in complex with its inhibitor phthalic acid. Proteins, 82, 2014
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3CWO
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![BU of 3cwo by Molmil](/molmil-images/mine/3cwo) | A beta/alpha-barrel built by the combination of fragments from different folds | Descriptor: | SULFATE ION, beta/alpha-barrel protein based on 1THF and 1TMY | Authors: | Bharat, T.A.M, Eisenbeis, S, Zeth, K, Hocker, B. | Deposit date: | 2008-04-22 | Release date: | 2008-07-08 | Last modified: | 2023-08-30 | Method: | X-RAY DIFFRACTION (3.1 Å) | Cite: | A beta alpha-barrel built by the combination of fragments from different folds. Proc.Natl.Acad.Sci.Usa, 105, 2008
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4ATZ
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![BU of 4atz by Molmil](/molmil-images/mine/4atz) | |
3BX7
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![BU of 3bx7 by Molmil](/molmil-images/mine/3bx7) | |
7JXN
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![BU of 7jxn by Molmil](/molmil-images/mine/7jxn) | |
4LNY
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![BU of 4lny by Molmil](/molmil-images/mine/4lny) | Crystal Structure of Engineered Protein, Northeast Structural Genomics Consortium Target OR422 | Descriptor: | CADMIUM ION, CHLORIDE ION, Engineered Protein OR422 | Authors: | Vorobiev, S, Su, M, Bjelic, S, Kipnis, Y, Wang, L, Sahdev, S, Xiao, R, Maglaqui, M, Kogan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) | Deposit date: | 2013-07-12 | Release date: | 2013-08-07 | Last modified: | 2023-12-06 | Method: | X-RAY DIFFRACTION (1.929 Å) | Cite: | Crystal Structure of Engineered Protein OR422. To be Published
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3B3N
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![BU of 3b3n by Molmil](/molmil-images/mine/3b3n) | Structure of neuronal NOS heme domain in complex with a inhibitor (+-)-N1-{cis-4'-[(6"-aminopyridin-2"-yl)methyl]pyrrolidin-3'-yl}ethane-1,2-diamine | Descriptor: | 5,6,7,8-TETRAHYDROBIOPTERIN, ACETATE ION, N-{(3S,4S)-4-[(6-aminopyridin-2-yl)methyl]pyrrolidin-3-yl}ethane-1,2-diamine, ... | Authors: | Igarashi, J, Li, H, Poulos, T.L. | Deposit date: | 2007-10-22 | Release date: | 2008-07-15 | Last modified: | 2024-02-21 | Method: | X-RAY DIFFRACTION (1.98 Å) | Cite: | Minimal pharmacophoric elements and fragment hopping, an approach directed at molecular diversity and isozyme selectivity. Design of selective neuronal nitric oxide synthase inhibitors. J.Am.Chem.Soc., 130, 2008
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5BVB
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![BU of 5bvb by Molmil](/molmil-images/mine/5bvb) | Engineered Digoxigenin binder DIG5.1a | Descriptor: | DIG5.1a, DIGOXIGENIN | Authors: | Doyle, L.A, Stoddard, B.L. | Deposit date: | 2015-06-04 | Release date: | 2015-10-28 | Last modified: | 2023-09-27 | Method: | X-RAY DIFFRACTION (2.06 Å) | Cite: | CSAR Benchmark Exercise 2013: Evaluation of Results from a Combined Computational Protein Design, Docking, and Scoring/Ranking Challenge. J.Chem.Inf.Model., 56, 2016
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4LPW
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![BU of 4lpw by Molmil](/molmil-images/mine/4lpw) | |
4JMH
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![BU of 4jmh by Molmil](/molmil-images/mine/4jmh) | |
7JXO
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![BU of 7jxo by Molmil](/molmil-images/mine/7jxo) | |
3CSB
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![BU of 3csb by Molmil](/molmil-images/mine/3csb) | |
4ZXZ
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![BU of 4zxz by Molmil](/molmil-images/mine/4zxz) | |
2RT4
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![BU of 2rt4 by Molmil](/molmil-images/mine/2rt4) | |
4JW2
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![BU of 4jw2 by Molmil](/molmil-images/mine/4jw2) | Selection of specific protein binders for pre-defined targets from an optimized library of artificial helicoidal repeat proteins (alphaRep) | Descriptor: | 1,2-ETHANEDIOL, A3 artificial protein, bA3-2: binder of A3 protein | Authors: | Guellouz, A, Valerio-Lepiniec, M, Urvoas, A, Chevrel, A, Graille, M, Fourati-Kammoun, Z, Desmadril, M, van Tilbeurgh, H, Minard, P. | Deposit date: | 2013-03-27 | Release date: | 2013-09-25 | Last modified: | 2023-09-20 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Selection of Specific Protein Binders for Pre-Defined Targets from an Optimized Library of Artificial Helicoidal Repeat Proteins (alphaRep). Plos One, 8, 2013
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5CHB
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![BU of 5chb by Molmil](/molmil-images/mine/5chb) | Crystal structure of nvPizza2-S16H58 coordinating a CdCl2 nanocrystal | Descriptor: | CADMIUM ION, CHLORIDE ION, SULFATE ION, ... | Authors: | Voet, A.R.D, Noguchi, H, Addy, C, Zhang, K.Y.J, Tame, J.R.H. | Deposit date: | 2015-07-10 | Release date: | 2015-07-22 | Last modified: | 2023-11-08 | Method: | X-RAY DIFFRACTION (1.55 Å) | Cite: | Biomineralization of a Cadmium Chloride Nanocrystal by a Designed Symmetrical Protein Angew.Chem.Int.Ed.Engl., 54, 2015
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7JRH
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![BU of 7jrh by Molmil](/molmil-images/mine/7jrh) | |
5AWL
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![BU of 5awl by Molmil](/molmil-images/mine/5awl) | CRYSTAL STRUCTURE OF A MUTANT OF CHIGNOLIN, CLN025 | Descriptor: | A mutant of Chignolin, CLN025 | Authors: | Akiba, T, Ishimura, M, Odahara, T, Harata, K, Honda, S. | Deposit date: | 2015-07-05 | Release date: | 2015-08-12 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (1.11 Å) | Cite: | Crystal structure of a ten-amino acid protein J.Am.Chem.Soc., 130, 2008
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