Alignments for a candidate for aacS in Desulfotomaculum ruminis DSM 2154

GapMind for catabolism of small carbon sources

Alignments for a candidate for aacS in Desulfotomaculum ruminis DSM 2154

Align Acetoacetate--CoA ligase (EC 6.2.1.16) (characterized)
to candidate WP_013840621.1 DESRU_RS02840 long-chain fatty acid--CoA ligase

Query= reanno::acidovorax_3H11:Ac3H11_3009
         (578 letters)



>NCBI__GCF_000215085.1:WP_013840621.1
          Length = 553

 Score =  282 bits (721), Expect = 3e-80
 Identities = 181/554 (32%), Positives = 299/554 (53%), Gaps = 27/554 (4%)

Query: 22  TDVPLIEQTIGAFFADMVARQPEREALVSVHQGRRYTYAQLQTEAHRLASALLGMGLTPG 81
           T V +  Q++  F      + P+ +A++ ++Q  + TY +L+    R A+AL  +G+  G
Sbjct: 17  TQVHIPNQSLYHFLDQATQKYPDHQAVIFMNQ--QLTYCELKERVDRFATALHVLGVKKG 74

Query: 82  DRVGIWSHNNAEWVLMQLATAQVGLVLVNINPAYRTAEVEYALNKVGCKLLVSMARF--K 139
           DRV I   N  + V+   A  ++G ++V  NP Y   E+ Y LN  G + ++ + +F  K
Sbjct: 75  DRVAIMLPNCPQTVIAYYAVIRLGAIVVMNNPLYVERELLYQLNNSGAETIIFLDQFQPK 134

Query: 140 TSDYLGMLRELAPEWQGQQPGHLQAAKLPQLKTVVWIDDEAGQGADEPGLLRFTELIARG 199
            S+             G        A LP  +T   ++   G       +L F +L+ + 
Sbjct: 135 ISNIKSQTSLKVFISTGISDYLAMPAMLPAPETQPVLNPPPGTD-----ILCFEDLLQKN 189

Query: 200 NAADPRLAQVAAGLQATDPINIQFTSGTTGFPKGATLTHRNILNNGFFIGECMKLTPADR 259
           +   P+  +V    +    + +Q+T GTTG  KGA LTH+N++ N    G  + +    R
Sbjct: 190 S---PKPPEVELDFEKELAV-LQYTGGTTGVSKGAMLTHKNLVANVLQTGAWLTICKEAR 245

Query: 260 ---LCIPVPLYHCFGMVLG-NLACFTHGATIVYPNDGFDPLTVLQTVQDERCTGLHGVPT 315
               C+ +P YH F M    NL+ +   A I+ P    + L  L+ + D R T    VP+
Sbjct: 246 ERFFCV-LPFYHVFAMTTCMNLSIYLSSAMILIPRLELNNL--LKLINDYRPTIFQAVPS 302

Query: 316 MFIAELDHPRFAEFNLSTLRTGIMAGSPCPTEVMKRVVEQMNLREITIAYGMTETSPVSC 375
           +++A + HP   +++LS++   +  G+P P EV ++  E +   ++   YG+TE +PV+ 
Sbjct: 303 LYVAIISHPEVQQYDLSSISCCLSGGAPLPIEVQEKF-EAITGGKLVEGYGLTEAAPVTH 361

Query: 376 QSSTDTPLSKRVS-TVGQVQPHLEVKIVDPDTGAV-VPIGQRGEFCTKGYSVMHGYWGDE 433
            +  +    K+V+ ++G   P+ +VKIV+ + G   VP+G+ GE C KG  VM GYW   
Sbjct: 362 CNPIE---GKKVNGSIGLAFPNTDVKIVEVEKGLEEVPLGETGELCIKGPQVMKGYWHMP 418

Query: 434 AKTREAIDEGGWMHTGDLATMDAEGYVNIVGRIKDMVIRGGENIYPREIEEFLYRHPQVQ 493
            +T  A+ +G W++TGD+A MD +G+  IV R KDMVI  G N+YPRE+EE LY+HP+V+
Sbjct: 419 EETAAALRDG-WLYTGDIARMDEQGFTYIVDRKKDMVITWGYNVYPREVEEVLYQHPKVK 477

Query: 494 DVQVVGVPDQKYGEELCAWIIAKPGTQPTEDDIRAFCKGQIAHYKVPRYIRFVTSFPMTV 553
           +  V+G+PD   GE + A+I+ K G Q T+++I  FC+  +A+YKVPR I F +  P + 
Sbjct: 478 EAAVIGIPDATRGEVIKAFIVLKEGQQATKEEIAGFCRKNLANYKVPRKIEFRSELPKSP 537

Query: 554 TGKIQKFKIRDEMK 567
            GKI +  + +E K
Sbjct: 538 VGKILRRMLSEETK 551


Lambda     K      H
   0.320    0.136    0.412 

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: 694
Number of extensions: 35
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: 578
Length of database: 553
Length adjustment: 36
Effective length of query: 542
Effective length of database: 517
Effective search space:   280214
Effective search space used:   280214
Neighboring words threshold: 11
Window for multiple hits: 40
X1: 16 ( 7.4 bits)
X2: 38 (14.6 bits)
X3: 64 (24.7 bits)
S1: 41 (21.8 bits)
S2: 53 (25.0 bits)

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

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