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Last Revised 06/02/08

NCBI Structure Group Research

Senior Investigator: Stephen H. Bryant

Affiliation:
Computational Biology Branch,
National Center for Biotechnology Information (NCBI), National Library of Medicine (NLM).
Contact: Dr. S. H. Bryant, Bldg. 38A, Room 5S504, NLM, NIH, 8600 Rockville Pike, Bethesda, MD 20894.
Tel: (301) 435-7792
Fax: (301) 480-9241 or (301) 435-7793
email bryant@ncbi.nlm.nih.gov


Comparative macromolecular 3D-structure analysis

Cn3D: Visualization of 3D structures and alignments

MMDB: "Computer-friendly" structure database

Threading: Algorithms for protein fold recognition

VAST: Protein structure-structure comparisons

CDD: A Conserved Domain Database

Entrez3D: WWW-retrieval tools for all of the above

PubChem: A database of small molecules and their biological activities

Selected Online Publications:

Chakrabarti S, Lanczycki CJ, Panchenko AR, Przytycka TM, Thiessen PA, Bryant SH. Refining multiple sequence alignments with conserved core regions. Nucleic Acids Res 2006; 34:2598-2606.

Panchenko AR, Madej T. Structural similarity of loops in protein families: toward the understanding of protein evolution. BMC Evol. Biol. 2005; 5:10.

Kann MG, Thiessen PA, Panchenko AR, Schaffer AA, Altschul SF, Bryant SH. A structure-based method for protein sequence alignment. Bioinformatics 2005; 21:1451-1456.

Marchler-Bauer A, Anderson JB, Cherukuri PF, DeWeese-Scott C, Geer LY, Gwadz M, He S, Hurwitz DI, Jackson JD, Ke Z, Lanczycki CJ, Liebert CA, Liu C, Lu F, Marchler GH, Mullokandov M, Shoemaker BA, Simonyan V, Song JS, Thiessen PA, Yamashita RA, Yin JJ, Zhang D, Bryant SH. CDD: a Conserved Domain Databse for protein classification. Nucleic Acids Res. 2005; 33:192-196.

Panchenko AR, Wolf YI, Panchenko LA, Madej T. Evolutionary plasticity of protein families: coupling between sequence and structure variation. Proteins 2005; Nov 15;61(3):535-44.

Panchenko AR, Madej T. Analysis of protein homology by assessing the (dis)similarity in protein loop regions. Proteins 2004; 57(3) 539-547.

Marchler-Bauer A, Bryant SH. CD-Search: protein domain annotations on the fly. Nucleic Acids Res. 2004; 32:327-331.

Chen J, Anderson JB, DeWeese-Scott C, Fedorova ND, Geer LY, He S, Hurwitz DI, Jackson JD, Jacobs AR, Lanczycki CJ, Liebert CA, Liu C, Madej T, Marchler-Bauer A, Marchler GH, Mazumder R, Nikolskaya AN, Rao BS, Panchenko AR, Shoemaker BA, Simonyan V, Song JS, Thiessen PA, Vasudevan S, Wang Y, Yamashita RA, Yin JJ, Bryant SH. MMDB: Entrez's 3D-structure database. Nucleic Acids Res. 2003; 31:474-477.

Marchler-Bauer A, Anderson JB, DeWeese-Scott C, Fedorova ND, Geer LY, He S, Hurwitz DI, Jackson JD, Jacobs AR, Lanczycki CJ, Liebert CA, Liu C, Madej T, Marchler GH, Mazumder R, Nikolskaya AN, Panchenko AR, Rao BS, Shoemaker BA, Simonyan V, Song JS, Thiessen PA, Vasudevan S, Wang Y, Yamashita RA, Yin JJ, Bryant SH. CDD: a curated Entrez database of conserved domain alignments. Nucleic Acids Res. 2003; 31:383-387.

Geer LY, Domrachev M, Lipman DJ, Bryant SH. CDART: protein homology by domain architecture. Genome Res. 2002; 12:1619-1623.

Wang Y, Anderson JB, Chen J, Geer LY, He S, Hurwitz DI, Liebert CA, Madej T, Marchler GH, Marchler-Bauer A, Panchenko AR, Shoemaker BA, Song JS, Thiessen PA, Yamashita RA, Bryant SH. MMDB: Entrez's 3D-structure database. Nucleic Acids Res 2002; 30:249-252.

Marchler-Bauer A, Panchenko AR, Shoemaker BA, Thiessen PA, Geer LY, Bryant SH. CDD: a database of conserved domain alignments with links to domain three-dimensional structure. Nucleic Acids Res 2002; 30:281-283.

Wang Y, Addess KJ, Geer L, Madej T, Marchler-Bauer A, Zimmerman D, Bryant SH. MMDB: 3D structure data in Entrez. Nucleic Acids Res 2000; 28:243-245.

Panchenko A, Marchler-Bauer A, Bryant SH. Threading with Explicit Models for Evolutionary Conservation of Structure and Sequence. Proteins Suppl 1999; 3:133-140.

Marchler-Bauer A, Addess KJ, Chappey C, Geer L, Madej T, Matsuo Y, Wang Y, Bryant SH. MMDB: Entrez's 3D structure database. Nucleic Acids Res 1999; 27:240-243.

Hogue CWV. Cn3D: a new generation of three-dimensional molecular structure viewer. Trends Biochem Sci 1997; 22:314-316.

Marchler-Bauer A, Bryant SH. A measure of success in fold recognition. Trends Biochem Sci 1997; 22:236-240.

Hogue CWV, Ohkawa H, Bryant SH. A dynamic look at structures: WWW-Entrez and the molecular modeling database. Trends Biochem. Sci 1996; 21:226-229.

Personnel (Click on link to send E-mail):

Ken Addess
John Anderson
Evan Bolton
Yulia Borodina
Saikat Chakrabarti
Farideh Chitsaz
Jie Chen
Arvind Chopra
Judy Dayhoff
Myra Derbyshire
Svetlana Dracheva
Jessica Fong
Lewis Geer
Renata Geer
Noreen Gonzales
Marc Gwadz
Lianyi Han
Jane He
Siqian He
David Hurwitz
John Jackson
Karen Karapetian
Zhaoxi Ke
Sunghwan Kim
Christopher Lanczycki
Cynthia Liebert
Chunlei Liu
Fu Lu
Shennan Lu
Tom Madej
Gabriele Marchler
Aron Marchler-Bauer
Mikhail Mullokandov
Anna Panchenko
Carol DeWeese-Scott
Wenyao Shi
Ben Shoemaker
Vahan Simonyan
James Song
Viswanadham Sridhara
Tugba Suzek
Asba Tasneem
Ratna R. Thangudu
Narmada Thanki
Paul Thiessen
Valery Tkachenko
Manoj Tyagi
Jiyao Wang
Yanli Wang
Jewen Xiao
Roxanne Yamashita
Dachuan Zhang
Huiming Zhang
Jeff Zhang
Jun Zhang
Naigong Zhang
Chanjuan Zheng
Zhigang Zhou

Structure Group Alumni (addresses):

Francois Major
Jean-Francois Gibrat
Hitomi Ohkawa
Christopher Hogue
Qiuwei Xu
Yo Matsuo
Wei Ding
Naomi Ariel
Diane Zimmerman
Anastasia Nikolskaya
Raja Mazumder
Natalie Fedorova
Aviva Jacobs
B. Sridhar Rao
Sona Vasudevan
Natasha Sefcovic
Luning Hao
Jane Tseng
Ren Yeh
Ken Cheng
Kam Leung
Elizabeth Lutanie
Praveen Cherukuri
Hsin-Yi Tsang
Fabien Fontaine
Maricel Kann
Wolf-Dietrich Ihlenfeldt
Ming Xu
Jodie Yin
Kenneth Evan Thompson
Dmitri Krylov


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