Published June 7, 2023 | Version 1.0.2

PDB70 Structural Library and Metadata

  • 1. Oak Ridge National Laboratory

Description

Protein structural library developed from the PDB70 sequence database as well as associated metadata for each structure. The structures associated with each entry in the PDB70 structural library are provided in a tarball. When available, the metadata for a protein has been gathered from UniProtKB flat files. A focus is given to enzyme commission (EC) number metadata as this type of ontology is of main focus for identifying and classifying enzymes within a proteome. 

Changelog: 

v1.0.2 - Added list file for structures that have active EC numbers, accounting for defunct EC numbers in UniProtKB metadata being replaced with an active EC number when relevant.

v1.0.1 - Small clean up of the provided .ipynb document. 

v1.0.0 - Original push of the PDB70 structural database and metadata.

Files

PDB70_structural_database_metadata.ipynb

Files (4.7 GB)

Name Size
md5:30569c5ab849c3758b7b71573931bd58
603.8 kB Download
md5:e54360a84113023fd744467a1e64b987
428.5 kB Download
md5:65cf5e21dff84671d1b551ed56c97a01
871.8 kB Download
md5:827a280c09edb8261f589f3e3ad87b65
43.1 kB Preview Download
md5:565473bce09a07f8aefb7c0c51355366
3.9 GB Download
md5:990797f90b7f6db8564e87fd7d3b8120
427.4 MB Download
md5:45065db9f676b6ebdb45997745c2e4cc
279.6 MB Download
md5:731d4dee9b1db69a1cf978ef20972289
1.6 MB Download
md5:ba15c7e58735054a016bb45c916c0e69
3.0 MB Download
md5:05a52eb0df4042fcded4b4f3f26edf89
3.1 kB Download

Additional details

Related works

Is compiled by
Software: https://github.com/BSDExabio/SAFA/releases/tag/v1.0.0 (URL)
Is supplement to
Dataset: 10.13139/ORNLNCCS/1973885 (DOI)