Project name: abc4adb7a8515a8 [mutate: TW45C, DW63C, KL90C] [mutate: TW45C, DW63C, KL35C]

Status: error

Started: 2026-01-09 00:09:31
Chain sequence(s) C: KKVVLGKKGDTVELTCTASQKKSIQFHWKNSNQIKILGNQGSFLTKGPSKLNDRADSRRSLWDQGNFPLIIKNLKIEDSDTYICEVEDQKEEVQLLVFGLTANSDTHLLQGQSLTLTLESPPGSSPSVQCRSPRGKNIQGGKTLSVSQLELQDSGTWTCTVLQNQKKVEFKIDIVVL
input PDB
Selected Chain(s) C
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode Yes
Automated mutations No
Mutated residues KL35C,TW45C,DW63C
Energy difference between WT (input) and mutated protein (by FoldX) 0.0 kcal/mol
Error log 
Aggrescan encountered an error and it wasn't one we were expecting. 
Please see the the following Traceback, perhaps it will be helpfull in understanding what happened.
We would be grateful if you reported the incident to one of the authors so we can correct the error.
Traceback (most recent call last):
  File "/home/users/lcbio/mambaforge/envs/Aggrescan4D/lib/python3.11/shutil.py", line 853, in move
    os.rename(src, real_dst)
FileNotFoundError: [Errno 2] No such file or directory: '/STORAGE/DATA/lcbio/aggreskan/abc4adb7a8515a8/folded.pdb' -> '/STORAGE/DATA/lcbio/aggreskan/abc4adb7a8515a8/tmp/folded.pdb'

During handling of the above exception, another exception occurred:

Traceback (most recent call last):
  File "/home/users/lcbio/Aggrescan4D-webserver-implementation/aggrescan/__main__.py", line 46, in run_program
    a.run_job()
  File "/home/users/lcbio/Aggrescan4D-webserver-implementation/aggrescan/newRunJob.py", line 141, in run_job
    shutil.move(
  File "/home/users/lcbio/mambaforge/envs/Aggrescan4D/lib/python3.11/shutil.py", line 873, in move
    copy_function(src, real_dst)
  File "/home/users/lcbio/mambaforge/envs/Aggrescan4D/lib/python3.11/shutil.py", line 448, in copy2
    copyfile(src, dst, follow_symlinks=follow_symlinks)
  File "/home/users/lcbio/mambaforge/envs/Aggrescan4D/lib/python3.11/shutil.py", line 258, in copyfile
    with open(dst, 'wb') as fdst:
         ^^^^^^^^^^^^^^^
FileNotFoundError: [Errno 2] No such file or directory: '/STORAGE/DATA/lcbio/aggreskan/abc4adb7a8515a8/tmp/folded.pdb'