| 57 | * http://www.myexperiment.org |
| 58 | |
| 59 | == Workflow Wishlist == |
| 60 | * Obtaining a sequence family and/or profile associated with a PDB entry |
| 61 | * This would involve: |
| 62 | 1. Get FASTA file for PDB chain (from RCSB-PDB, MSD-EBI, or PDBj) |
| 63 | 2. Get family and/or profile (from NCBI, UNIPROT or DDBJ) |
| 64 | |
| 65 | * Build phylogenetic tree from set of sequence and structure alignments |
| 66 | * This is trickier then the above example, but one approach would be: |
| 67 | 1. Cluster sequences using clustalw (from NCBI,EBI, DDBJ) |
| 68 | 2. Collect the PDB IDs for each sequence that has a structure (from RCSB-PDB, MSD-EBI, or PDBj:Sequence Navigator) |
| 69 | 3. Compute all-on-all structure alignments for those sequences with structures (from MSD-EBI:SSM or PDBj:ASH) |
| 70 | 4. Now, combine all the sequence scores and structure scores (if available) into a single distance matrix |
| 71 | 5. Compute tree from distance matrix |
| 72 | |
| 73 | |