diff --git a/docs/source/userguide/configuration.rst b/docs/source/userguide/configuration.rst index 52036aa7..8b68ea45 100644 --- a/docs/source/userguide/configuration.rst +++ b/docs/source/userguide/configuration.rst @@ -123,7 +123,7 @@ be configured separately. For instance: .. code-block:: json "fixed_modifications": { - "C": "U:Carbamidomethyl" + "U:Carbamidomethyl": ["C"] } .. tab:: TOML @@ -131,7 +131,7 @@ be configured separately. For instance: .. code-block:: toml [ms2rescore.fixed_modifications] - "Carbamidomethyl" = ["C"] + "U:Carbamidomethyl" = ["C"] .. tab:: GUI @@ -140,6 +140,28 @@ be configured separately. For instance: :alt: fixed modifications configuration in GUI +Fixed terminal modifications can be added by using the special labels ``N-term`` and ``C-term``. +For example, to additionally add TMT6plex to the N-terminus and lysine residues, the following +configuration can be used: + +.. tab:: JSON + + .. code-block:: json + + "fixed_modifications": { + "U:Carbamidomethyl": ["C"], + "U:TMT6plex": ["N-term", "K"] + } + +.. tab:: TOML + + .. code-block:: toml + + [ms2rescore.fixed_modifications] + "U:Carbamidomethyl" = ["C"] + "U:TMT6plex" = ["N-term", "K"] + + .. caution:: Most search engines DO return fixed modifications as part of the modified peptide sequences. In these cases, they must NOT be added to the ``fixed_modifications`` configuration.