Hydration in drug design. 2. Influence of local site surface shape on water binding (Q71491560)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

title

Hydration in drug design. 2. Influence of local site surface shape on water binding (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

author name string

C S Poornima

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

P M Dean

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

publication date

1 December 1995

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computer - Aided Molecular Design

19 October 2019

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

volume

9

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

issue

6

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

19 October 2019

page(s)

513-520

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

https://scigraph.springernature.com/pub.10.1007/bf00124322

19 October 2019

exact match

0 references

cites work

Hydration of proteins. A comparison of experimental residence times of water molecules solvating the bovine pancreatic trypsin inhibitor with theoretical model calculations

1 reference

12 December 2020

Heteronuclear 3D NMR studies of water bound to an FK506 binding protein/immunosuppressant complex

1 reference

12 December 2020

Crystallographic analysis of a complex between human immunodeficiency virus type 1 protease and acetyl-pepstatin at 2.0-A resolution

1 reference

12 December 2020

Crystal structure of cobra-venom phospholipase A2 in a complex with a transition-state analogue

1 reference

12 December 2020

X-ray structure of nucleoside diphosphate kinase complexed with thymidine diphosphate and Mg2+ at 2-A resolution

1 reference

12 December 2020

Internal cavities and buried waters in globular proteins.

1 reference

12 December 2020

Buried water in homologous serine proteases

1 reference

12 December 2020

Structure of holo-glyceraldehyde-3-phosphate dehydrogenase from Bacillus stearothermophilus at 1.8 A resolution

1 reference

12 December 2020

Structure of the triosephosphate isomerase-phosphoglycolohydroxamate complex: an analogue of the intermediate on the reaction pathway

1 reference

12 December 2020

Solvent-accessible surfaces of proteins and nucleic acids

1 reference

12 December 2020

Detection of long-lived bound water molecules in complexes of human dihydrofolate reductase with methotrexate and NADPH.

1 reference

12 December 2020

Crystal structure of cholesterol oxidase complexed with a steroid substrate: implications for flavin adenine dinucleotide dependent alcohol oxidases

1 reference

12 December 2020

Refined crystal structure of the triphosphate conformation of H-ras p21 at 1.35 A resolution: implications for the mechanism of GTP hydrolysis

1 reference

12 December 2020

Structure of glutathione reductase from Escherichia coli at 1.86 A resolution: comparison with the enzyme from human erythrocytes

1 reference

12 December 2020

Identification and localization of bound internal water in the solution structure of interleukin 1 beta by heteronuclear three-dimensional 1H rotating-frame Overhauser 15N-1H multiple quantum coherence NMR spectroscopy.

1 reference

12 December 2020

Solvent structure in crystals of trypsin determined by X-ray and neutron diffraction

1 reference

12 December 2020

Refined crystal structure of type III chloramphenicol acetyltransferase at 1.75 A resolution

1 reference

12 December 2020

Complex of ribonuclease from Streptomyces aureofaciens with 2'-GMP at 1.7 A resolution

1 reference

12 December 2020

Crystallographic refinement and atomic models of two different forms of citrate synthase at 2.7 and 1.7 A resolution

1 reference

12 December 2020

Response of a protein structure to cavity-creating mutations and its relation to the hydrophobic effect

1 reference

12 December 2020

The crystal structure of the ternary complex of staphylococcal nuclease, Ca2+, and the inhibitor pdTp, refined at 1.65 A

1 reference

12 December 2020

A molecular dynamics study of thermodynamic and structural aspects of the hydration of cavities in proteins.

1 reference

12 December 2020

Structures of product and inhibitor complexes of Streptomyces griseus protease A at 1.8 A resolution. A model for serine protease catalysis

1 reference

12 December 2020

Areas, volumes, packing and protein structure

1 reference

12 December 2020

Hydration in drug design. 3. Conserved water molecules at the ligand-binding sites of homologous proteins.

1 reference

12 December 2020

Intramolecular cavities in globular proteins

1 reference

12 December 2020

Design and synthesis of new enzymes based on the lactate dehydrogenase framework

1 reference

12 December 2020

Accurate simulation of protein dynamics in solution

1 reference

12 December 2020

Protein hydration in aqueous solution

1 reference

12 December 2020

Atomic structure of FKBP-FK506, an immunophilin-immunosuppressant complex

1 reference

12 December 2020

The interdependence of protein surface topography and bound water molecules revealed by surface accessibility and fractal density measures

1 reference

12 December 2020

Sugar and signal-transducer binding sites of the Escherichia coli galactose chemoreceptor protein

1 reference

12 December 2020

Structure of human neutrophil elastase in complex with a peptide chloromethyl ketone inhibitor at 1.84-A resolution

1 reference

12 December 2020

Substrate specificity and affinity of a protein modulated by bound water molecules

1 reference

12 December 2020

Crystal structure of an actinidin-E-64 complex

1 reference

12 December 2020

Inhibition of thermolysin and neutral endopeptidase 24.11 by a novel glutaramide derivative: X-ray structure determination of the thermolysin-inhibitor complex

1 reference

12 December 2020

Water-mediated substrate/product discrimination: the product complex of thymidylate synthase at 1.83 A

1 reference

12 December 2020

X-ray crystallographic structures of adipocyte lipid-binding protein complexed with palmitate and hexadecanesulfonic acid. Properties of cavity binding sites

1 reference

12 December 2020

Hydration in drug design. 1. Multiple hydrogen-bonding features of water molecules in mediating protein-ligand interactions

1 reference

12 December 2020

Conserved waters in legume lectin crystal structures. The importance of bound water for the sequence-structure relationship within the legume lectin family

1 reference

12 December 2020

Refined structure of the complex between guanylate kinase and its substrate GMP at 2·0 Å resolution

1 reference

12 December 2020

Analysis of solvent structure in proteins using neutron D2O-H2O solvent maps: pattern of primary and secondary hydration of trypsin

1 reference

12 December 2020

The interpretation of protein structures: Estimation of static accessibility

1 reference

12 December 2020

Determination of the positions of bound water molecules in the solution structure of reduced human thioredoxin by heteronuclear three-dimensional nuclear magnetic resonance spectroscopy

1 reference

12 December 2020

Buried waters and internal cavities in monomeric proteins

1 reference

12 December 2020

A cavity-containing mutant of T4 lysozyme is stabilized by buried benzene

1 reference

12 December 2020

Crystal structures of Escherichia coli and Lactobacillus casei dihydrofolate reductase refined at 1.7 A resolution. I. General features and binding of methotrexate

1 reference

12 December 2020

Identifiers

DOI

10.1007/BF00124322

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:8789193%20AND%20SRC:MED&resulttype=core&format=json

journals/jcamd/PoornimaD95a

19 October 2019

DBLP publication ID

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference