Alignments for a candidate for acn in Caldicellulosiruptor kronotskyensis 2002

GapMind for catabolism of small carbon sources

Alignments for a candidate for acn in Caldicellulosiruptor kronotskyensis 2002

Align aconitate hydratase (EC 4.2.1.3) (characterized)
to candidate WP_013429581.1 CALKRO_RS02690 3-isopropylmalate dehydratase large subunit

Query= BRENDA::P19414
         (778 letters)



>NCBI__GCF_000166775.1:WP_013429581.1
          Length = 429

 Score =  177 bits (450), Expect = 8e-49
 Identities = 139/452 (30%), Positives = 216/452 (47%), Gaps = 44/452 (9%)

Query: 55  LNRPFTYAEKILYGHLDDPHGQDIQRGVSYLKLRPDRVACQDATAQMAILQFMSAGLPQV 114
           + +P T ++KIL  H     G++       +    D V   D T  +AI +F   G+ +V
Sbjct: 1   MTKPMTMSQKILAYHA----GKEYVEPGDLIFANVDLVLGNDVTTPVAIKEFEKIGIDRV 56

Query: 115 --AKPVTVHCDHLIQAQVGGEKDLKRAIDLNKEVYDFLASATAKYNM-GFWKPGS-GIIH 170
                + +  DH         KD+K A    K V +F      KY +  +++ G  GI H
Sbjct: 57  FDKDKIAIVPDHFTP-----NKDIKSAQQC-KMVREF----AKKYEITNYFEVGEMGIEH 106

Query: 171 QIVLEN-YAFPGALIIGTDSHTPNAGGLGQLAIGVGGADAVDVMA-GRPWELKAPKILGV 228
            ++ E     PG L+IG DSHT   G LG  + G+G  D    MA G+ W  K P+ +  
Sbjct: 107 ALLPEKGLVVPGDLVIGADSHTCTYGALGAFSTGIGSTDMACAMATGKCW-FKVPEAIKF 165

Query: 229 KLTGKMNGWTSPKDIILKLAGITTVKGGTGKIVEYFGDGVDTFSATGMGTICNMGAEIGA 288
            L GK  GWTS KDIIL + G+  V G   K +EY G+G+ + S     TI NM  E GA
Sbjct: 166 ILYGKKTGWTSGKDIILHIIGMIGVDGALYKSMEYTGEGLKSLSMDDRFTIANMAIEAGA 225

Query: 289 TTSVFPFNKSMIEYLEATGRGKIADFAKLYHKDLLSADKDAEYDEVVEIDLNTLEPYING 348
              +F  ++  IEY++           K Y   +  AD+DAEY +V EID++ + P +  
Sbjct: 226 KNGIFEVDEKTIEYVKQHS-------TKPY--KIFKADEDAEYSQVFEIDISKIRPTVAF 276

Query: 349 PFTPDLATPVSKMKEVAVANNWPLDVRVGLIGSCTNSSYEDMSRSASIVKDAAAHGLKSK 408
           P  P+    + ++ E        + +   +IGSCTN   ED+  +A I+K      +K  
Sbjct: 277 PHLPENTKTIDEITE-------KIYIDQVVIGSCTNGRIEDLRIAAKILK---GRKVKKG 326

Query: 409 TIFTVTPGSEQIRATIERDGQLETFKEFGGIVLANACGPCIGQWDRRDIKKGDKNTIVSS 468
               + P ++ I     ++G +E F + G +V    CGPC+G      +  G+K   +++
Sbjct: 327 LRCIIFPTTQNIYKQALKEGLIEIFIDAGCVVSTPTCGPCLG-GHMGILADGEK--ALAT 383

Query: 469 YNRNFTSRNDGNPQTHAFVASPELVTAFAIAG 500
            NRNF  R  G+P +  +++SP +  A A+ G
Sbjct: 384 TNRNFVGRM-GHPNSEVYLSSPAIAAASAVLG 414


Lambda     K      H
   0.317    0.136    0.405 

Gapped
Lambda     K      H
   0.267   0.0410    0.140 


Matrix: BLOSUM62
Gap Penalties: Existence: 11, Extension: 1
Number of Sequences: 1
Number of Hits to DB: 795
Number of extensions: 30
Number of successful extensions: 5
Number of sequences better than 1.0e-02: 1
Number of HSP's gapped: 1
Number of HSP's successfully gapped: 1
Length of query: 778
Length of database: 429
Length adjustment: 36
Effective length of query: 742
Effective length of database: 393
Effective search space:   291606
Effective search space used:   291606
Neighboring words threshold: 11
Window for multiple hits: 40
X1: 16 ( 7.3 bits)
X2: 38 (14.6 bits)
X3: 64 (24.7 bits)
S1: 41 (21.6 bits)
S2: 53 (25.0 bits)

This GapMind analysis is from Sep 24 2021. The underlying query database was built on Sep 17 2021.

Downloads

Candidates (tab-delimited)
Steps (tab-delimited)
Rules (tab-delimited)
Protein sequences (fasta format)
Organisms (tab-delimited)
SQLite3 databases

Related tools

About GapMind

Each pathway is defined by a set of rules based on individual steps or genes. Candidates for each step are identified by using ublast (a fast alternative to protein BLAST) against a database of manually-curated proteins (most of which are experimentally characterized) or by using HMMer with enzyme models (usually from TIGRFam). Ublast hits may be split across two different proteins.

A candidate for a step is "high confidence" if either:

ublast finds a hit to a characterized protein at above 40% identity and 80% coverage, and bits >= other bits+10.
- (Hits to curated proteins without experimental data as to their function are never considered high confidence.)
HMMer finds a hit with 80% coverage of the model, and either other identity < 40 or other coverage < 0.75.

where "other" refers to the best ublast hit to a sequence that is not annotated as performing this step (and is not "ignored").

Otherwise, a candidate is "medium confidence" if either:

ublast finds a hit at above 40% identity and 70% coverage (ignoring otherBits).
ublast finds a hit at above 30% identity and 80% coverage, and bits >= other bits.
HMMer finds a hit (regardless of coverage or other bits).

Other blast hits with at least 50% coverage are "low confidence."

Steps with no high- or medium-confidence candidates may be considered "gaps." For the typical bacterium that can make all 20 amino acids, there are 1-2 gaps in amino acid biosynthesis pathways. For diverse bacteria and archaea that can utilize a carbon source, there is a complete high-confidence catabolic pathway (including a transporter) just 38% of the time, and there is a complete medium-confidence pathway 63% of the time. Gaps may be due to:

our ignorance of proteins' functions,
omissions in the gene models,
frame-shift errors in the genome sequence, or
the organism lacks the pathway.

GapMind relies on the predicted proteins in the genome and does not search the six-frame translation. In most cases, you can search the six-frame translation by clicking on links to Curated BLAST for each step definition (in the per-step page).

For more information, see:

the paper from 2019 on GapMind for amino acid biosynthesis
the paper from 2022 on GapMind for carbon sources
the source code
instructions for running GapMind on your computer

If you notice any errors or omissions in the step descriptions, or any questionable results, please let us know

by Morgan Price, Arkin group, Lawrence Berkeley National Laboratory

GapMind for catabolism of small carbon sources