From models/saxs_stefan_16Apr2020
Input:
ATOM 1091 N GLN B 907 4.239 76.502 20.970 1.00 99.89 N
ANISOU 1091 N GLN B 907 15316 10099 12538 72 1732 1807 N
ATOM 1092 CA GLN B 907 3.655 75.134 20.742 1.00 95.95 C
ANISOU 1092 CA GLN B 907 14550 10092 11814 288 1387 1699 C
ATOM 1093 C GLN B 907 4.570 74.198 19.914 1.00 95.02 C
ANISOU 1093 C GLN B 907 14327 10149 11629 162 1609 1739 C
ATOM 1094 O GLN B 907 5.309 74.638 19.015 1.00 98.68 O
ANISOU 1094 O GLN B 907 15100 10381 12014 94 2040 1947 O
ATOM 1095 CB GLN B 907 2.306 75.271 20.029 1.00 97.33 C
ANISOU 1095 CB GLN B 907 15072 10348 11559 817 1125 1805 C
Command:
multipr --chain GPLGSSSPADSYNEGVKLQP multiprotl/Dimer_parallel.pdb:B QTRPH --chain GPLGSSSPADSYNEGVKLQPQ multiprotl/Dimer_parallel.pdb:C TRPH
Output:
Chain 1
Modeling with ranch...
* Ranch failed to build the chain:
ERROR (SEQUENCE ALIGNMENT): mismatch between Sequence and PDB files detected!
Traceback (most recent call last):
File "/Users/guzmanfj/Documents/Stefan/multiprot/venv_multipr/bin/multipr", line 20, in <module>
model = build.run()
File "/Users/guzmanfj/Documents/Stefan/multiprot/venv_multipr/lib/python3.7/site-packages/multiprot/builder.py", line 651, in run
self.create_full()
File "/Users/guzmanfj/Documents/Stefan/multiprot/venv_multipr/lib/python3.7/site-packages/multiprot/builder.py", line 573, in create_full
models = self.call_ranch(chaini)[:self.num]
File "/Users/guzmanfj/Documents/Stefan/multiprot/venv_multipr/lib/python3.7/site-packages/multiprot/builder.py", line 197, in call_ranch
raise RanchError('Models not produced.')
multiprot.errors.RanchError: Models not produced.
Could be either the atomic numbering, residue numbering or chain ids. Most likely is the atomic numbering.
From
models/saxs_stefan_16Apr2020Input:
Command:
Output:
Could be either the atomic numbering, residue numbering or chain ids. Most likely is the atomic numbering.