High‐resolution crystal structures leverage protein binding affinity predictions

S Marillet, P Boudinot, F Cazals - Proteins: structure, function …, 2016 - Wiley Online Library
… the structureaffinity‐benchmark (SAB, 144 cases with bound/unbound crystal structures
and experimental affinity … First, we present models yielding a marked improvement of affinity

Crystal structure of human interferon-λ1 in complex with its high-affinity receptor interferon-λR1

ZJ Miknis, E Magracheva, W Li, A Zdanov… - Journal of molecular …, 2010 - Elsevier
… the crystal structure of IFN-λ1 bound to its high-affinity receptor IFN-… The crystal structures
were solved using molecular replacement … Since the two structures determined in this work are …

Binding of a high affinity phosphotyrosyl peptide to the Src SH2 domain: crystal structures of the complexed and peptide-free forms

G Waksman, SE Shoelson, N Pant, D Cowburn… - Cell, 1993 - cell.com
… We present the crystal structure, determined at a resolution of 2.7 A, of the complex … structure
of the uncomplexed form of Src SH2, at a resolution of 2.5 A. We show that the high affinity

Crystal structure of rhizavidin: insights into the enigmatic high-affinity interaction of an innate biotin-binding protein dimer

A Meir, SH Helppolainen, E Podoly… - Journal of molecular …, 2009 - Elsevier
… , exhibits high affinity towards biotin but maintains an inherent dimeric quaternary structure
… loop that plays a crucial role in high-affinity binding and oligomeric stability of the tetrameric …

Characterization and Crystal Structure of a High-Affinity Pentavalent Receptor-Binding Inhibitor for Cholera Toxin and E. coli Heat-Labile Enterotoxin

EA Merritt, Z Zhang, JC Pickens, M Ahn… - Journal of the …, 2002 - ACS Publications
… is whether proportional affinity gains … high-resolution crystal structure of the complex between
our designed pentavalent ligand and the B pentamer of cholera toxin. The crystal structure

High‐resolution crystal structure of human Mapkap kinase 3 in complex with a high affinity ligand

R Cheng, B Felicetti, S Palan… - Protein …, 2010 - Wiley Online Library
… , has been slowed by the absence of a high-resolution crystal structure of MK2. Herein we
present a high-resolution (1.9 Å) crystal structure of the highly homologous MK3 in complex …

Crystal structure of the abl-SH3 domain complexed with a designed high-affinity peptide ligand: implications for SH3-ligand interactions

MT Pisabarro, L Serrano, M Wilmanns - Journal of molecular biology, 1998 - Elsevier
high-resolution structure of the Abl-SH3:p41 complex, we discuss the structural determinants
of high affinity … comparison of the crystal structures, we assume that the increased binding …

Crystal structure of NF-κB (p50)2 complexed to a high-affinity RNA aptamer

DB Huang, D Vu, LA Cassiday… - Proceedings of the …, 2003 - National Acad Sciences
… We describe here the 2.45-Å resolution x-ray crystal structure of the p50 RHR/RNA aptamer
crystal structure of the NF-κB p50 RHR homodimer bound to this high-affinity RNA aptamer. …

Design, synthesis, and kinetic evaluation of high-affinity FKBP ligands and the X-ray crystal structures of their complexes with FKBP12

DA Holt, JI Luengo, DS Yamashita, HJ Oh… - Journal of the …, 2002 - ACS Publications
The design and synthesis of high-affinity FKBP 12 ligands is described. These compounds
potently inhibit the m-rrans-peptidylprolyl isomerase (rotamase) activity catalyzed by FKBP 12 …

Crystal structure of a high-affinity variant of rat α-parvalbumin

YH Lee, JJ Tanner, JD Larson, MT Henzl - Biochemistry, 2004 - ACS Publications
… have obtained high-resolution X-ray crystallographic data for … to the heightened divalent
ion affinity. DSC data indicate that … buffer, divalent ion affinity is markedly higher. In 0.15 M KCl …