Alignments for a candidate for ilvD in Desulfotomaculum ruminis DSM 2154

GapMind for Amino acid biosynthesis

Alignments for a candidate for ilvD in Desulfotomaculum ruminis DSM 2154

Align dihydroxy-acid dehydratase subunit (EC 4.2.1.9) (characterized)
to candidate WP_013840428.1 DESRU_RS01855 dihydroxy-acid dehydratase

Query= metacyc::MONOMER-11919
         (549 letters)



>NCBI__GCF_000215085.1:WP_013840428.1
          Length = 552

 Score =  623 bits (1607), Expect = 0.0
 Identities = 316/552 (57%), Positives = 411/552 (74%), Gaps = 5/552 (0%)

Query: 1   MKSDTIKRGIQRAPHRSLLARCGLTDDDFEKPFIGIANSYTDIVPGHIHLRELAEAVKEG 60
           M+SD +K+G++RAPHRSL    GL D++  KP IG+ NS+ +IVPGH+HL+++AEAVK G
Sbjct: 1   MRSDAMKKGLERAPHRSLFRALGLVDEELSKPMIGVVNSFNEIVPGHMHLKDIAEAVKAG 60

Query: 61  VNAAGGVAFEFNTMAICDGIAMNHDGMKYSLASREIVADTVESMAMAHALDGLVLLPTCD 120
           V  AGG   EF  +A+CDGIAM H GM+YSLASREI+AD++E MA AH  DGLVL+P CD
Sbjct: 61  VRMAGGTPVEFPAIAVCDGIAMGHPGMRYSLASREIIADSIEVMAQAHPFDGLVLIPNCD 120

Query: 121 KIVPGMLMAAARLDIPAIVVTGGPMLPGEFKGRKVDLINVYEGVGTVSAGEMSEDELEEL 180
           K+VPGMLMAAARL+IPAIVV+GGPM+ G F+ + V + N++E VG V AG M+ +EL +L
Sbjct: 121 KVVPGMLMAAARLNIPAIVVSGGPMMAGRFQDKDVSVTNIFEAVGAVQAGRMTPEELAQL 180

Query: 181 ERCACPGPRSCAGLFTANTMACLTEALGMSLPGCATAHAVSSRKRQIARLSGKRIVEMVQ 240
           E  ACPG  SC+G+FTAN+M CLTE LGM+LPG  T  AVS+ +R++A+++G R V +VQ
Sbjct: 181 EDSACPGCGSCSGMFTANSMNCLTEVLGMALPGNGTIPAVSAARRRLAKMTGIRAVSLVQ 240

Query: 241 ENLKPTMIMSQEAFENAVMVDLALGGSTNTTLHIPAIAAEIDGLNINLDLFDELSRVIPH 300
           ENL+P  I++ +AF N + VDLALG STNT LH+PAIA E  G+ ++L+L +++S   PH
Sbjct: 241 ENLRPCDILTAKAFANGLTVDLALGCSTNTVLHLPAIAHEA-GIELDLNLVNQMSEKTPH 299

Query: 301 IASISPAGEHMMLDLDRAGGIPAVLKTL--EDHINRECVTCTGRTVQENIENVKVGHRDV 358
           +  +SPAGEH + +L  AGGI AV+K L  +D IN      +G TV E +    V    V
Sbjct: 300 LCKLSPAGEHHIENLYAAGGIQAVMKELSRKDLINLNIKAVSGLTVGEQLAQAGVKDNGV 359

Query: 359 IRPLDSPVHSEGGLAILRGNLAPRGSVVKQGAVAEDMMVHEGPAKVFNSEDECMEAIFGG 418
           IR +  P  + GGLAILRGNLAP G+VVK+ AVA +M+ H GPA+VF+ E+  ++AI GG
Sbjct: 360 IRSVSEPYSATGGLAILRGNLAPDGAVVKRAAVAPEMLKHTGPARVFDGEEAAIQAIMGG 419

Query: 419 RIDEGDVIVIRYEGPKGGPGMREMLNPTSAIAGMGLER-VALITDGRFSGGTRGPCVGHV 477
           RI  GDV+VIRYEGPKGGPGMREML PTSA+AGMGL++ VAL+TDGRFSG +RG  +GHV
Sbjct: 420 RIKPGDVVVIRYEGPKGGPGMREMLMPTSALAGMGLDKEVALLTDGRFSGASRGASIGHV 479

Query: 478 SPEAMEDGPLAAVNDGDIIRIDIPSRKLEVDLSPREIEERLQSAVKPR-RSVKGWLARYR 536
           SPEA E G ++ + DGDI+ IDIP+ +LEV LS  EI+ER  +   P+ R  KG+LARY 
Sbjct: 480 SPEAAEGGLISVLQDGDIVEIDIPNYRLEVQLSEAEIKERQANWQPPQPRVTKGYLARYA 539

Query: 537 KLAGSADTGAVL 548
           +L  SA  GAVL
Sbjct: 540 RLVTSAGKGAVL 551


Lambda     K      H
   0.319    0.136    0.397 

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: 971
Number of extensions: 48
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: 549
Length of database: 552
Length adjustment: 36
Effective length of query: 513
Effective length of database: 516
Effective search space:   264708
Effective search space used:   264708
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 (21.7 bits)
S2: 53 (25.0 bits)

Align candidate WP_013840428.1 DESRU_RS01855 (dihydroxy-acid dehydratase)
to HMM TIGR00110 (ilvD: dihydroxy-acid dehydratase (EC 4.2.1.9))

# hmmsearch :: search profile(s) against a sequence database
# HMMER 3.3.1 (Jul 2020); http://hmmer.org/
# Copyright (C) 2020 Howard Hughes Medical Institute.
# Freely distributed under the BSD open source license.
# - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -
# query HMM file:                  ../tmp/path.aa/TIGR00110.hmm
# target sequence database:        /tmp/gapView.22621.genome.faa
# - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -

Query:       TIGR00110  [M=543]
Accession:   TIGR00110
Description: ilvD: dihydroxy-acid dehydratase
Scores for complete sequences (score includes all domains):
   --- full sequence ---   --- best 1 domain ---    -#dom-
    E-value  score  bias    E-value  score  bias    exp  N  Sequence                                 Description
    ------- ------ -----    ------- ------ -----   ---- --  --------                                 -----------
   4.8e-250  816.6   6.5   5.5e-250  816.4   6.5    1.0  1  lcl|NCBI__GCF_000215085.1:WP_013840428.1  DESRU_RS01855 dihydroxy-acid deh


Domain annotation for each sequence (and alignments):
>> lcl|NCBI__GCF_000215085.1:WP_013840428.1  DESRU_RS01855 dihydroxy-acid dehydratase
   #    score  bias  c-Evalue  i-Evalue hmmfrom  hmm to    alifrom  ali to    envfrom  env to     acc
 ---   ------ ----- --------- --------- ------- -------    ------- -------    ------- -------    ----
   1 !  816.4   6.5  5.5e-250  5.5e-250       1     541 [.      14     551 ..      14     552 .] 1.00

  Alignments for each domain:
  == domain 1  score: 816.4 bits;  conditional E-value: 5.5e-250
                                 TIGR00110   1 aarallkatGlkdedlekPiiavvnsyteivPghvhlkdlaklvkeeieaaGgvakefntiavsDGiam 69 
                                               ++r+l++a+Gl de+l+kP+i+vvns++eivPgh+hlkd+a++vk++++ aGg+++ef  iav+DGiam
  lcl|NCBI__GCF_000215085.1:WP_013840428.1  14 PHRSLFRALGLVDEELSKPMIGVVNSFNEIVPGHMHLKDIAEAVKAGVRMAGGTPVEFPAIAVCDGIAM 82 
                                               69******************************************************************* PP

                                 TIGR00110  70 gheGmkysLpsreiiaDsvetvvkahalDalvvissCDkivPGmlmaalrlniPaivvsGGpmeagktk 138
                                               gh Gm+ysL+sreiiaDs+e +++ah +D+lv+i++CDk+vPGmlmaa+rlniPaivvsGGpm+ag+++
  lcl|NCBI__GCF_000215085.1:WP_013840428.1  83 GHPGMRYSLASREIIADSIEVMAQAHPFDGLVLIPNCDKVVPGMLMAAARLNIPAIVVSGGPMMAGRFQ 151
                                               ********************************************************************* PP

                                 TIGR00110 139 lsekidlvdvfeavgeyaagklseeeleeiersacPtagsCsGlftansmacltealGlslPgsstlla 207
                                                 ++++++++feavg+++ag+++ eel ++e+sacP++gsCsG+ftansm+clte+lG++lPg++t++a
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 152 -DKDVSVTNIFEAVGAVQAGRMTPEELAQLEDSACPGCGSCSGMFTANSMNCLTEVLGMALPGNGTIPA 219
                                               .8******************************************************************* PP

                                 TIGR00110 208 tsaekkelakksgkrivelvkknikPrdiltkeafenaitldlalGGstntvLhllaiakeagvklsld 276
                                               +sa +++lak +g r v lv++n++P dilt +af n +t+dlalG stntvLhl+aia+eag++l+l+
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 220 VSAARRRLAKMTGIRAVSLVQENLRPCDILTAKAFANGLTVDLALGCSTNTVLHLPAIAHEAGIELDLN 288
                                               ********************************************************************* PP

                                 TIGR00110 277 dfdrlsrkvPllaklkPsgkkviedlhraGGvsavlkeldkegllhkdaltvtGktlaetlekvkvlrv 345
                                                ++++s+k+P+l+kl+P+g++ ie+l +aGG++av+kel++++l++ ++++v+G t++e+l+++ v+  
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 289 LVNQMSEKTPHLCKLSPAGEHHIENLYAAGGIQAVMKELSRKDLINLNIKAVSGLTVGEQLAQAGVK-- 355
                                               *******************************************************************.. PP

                                 TIGR00110 346 dqdvirsldnpvkkegglavLkGnlaeeGavvkiagveedilkfeGpakvfeseeealeailggkvkeG 414
                                               d+ virs+++p++++ggla+L+Gnla++Gavvk a+v+ ++lk++Gpa+vf+ ee+a++ai+gg++k G
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 356 DNGVIRSVSEPYSATGGLAILRGNLAPDGAVVKRAAVAPEMLKHTGPARVFDGEEAAIQAIMGGRIKPG 424
                                               ********************************************************************* PP

                                 TIGR00110 415 dvvviryeGPkGgPGmremLaPtsalvglGLgkkvaLitDGrfsGgtrGlsiGhvsPeaaegGaialve 483
                                               dvvviryeGPkGgPGmremL+Ptsal+g+GL+k+vaL+tDGrfsG++rG siGhvsPeaaegG i++++
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 425 DVVVIRYEGPKGGPGMREMLMPTSALAGMGLDKEVALLTDGRFSGASRGASIGHVSPEAAEGGLISVLQ 493
                                               ********************************************************************* PP

                                 TIGR00110 484 dGDkikiDienrkldlevseeelaerrakakkkearevkgaLakyaklvssadkGavl 541
                                               dGD+++iDi+n +l++++se+e++er+a+++++++r +kg+La+ya+lv+sa kGavl
  lcl|NCBI__GCF_000215085.1:WP_013840428.1 494 DGDIVEIDIPNYRLEVQLSEAEIKERQANWQPPQPRVTKGYLARYARLVTSAGKGAVL 551
                                               ********************************************************97 PP



Internal pipeline statistics summary:
-------------------------------------
Query model(s):                            1  (543 nodes)
Target sequences:                          1  (552 residues searched)
Passed MSV filter:                         1  (1); expected 0.0 (0.02)
Passed bias filter:                        1  (1); expected 0.0 (0.02)
Passed Vit filter:                         1  (1); expected 0.0 (0.001)
Passed Fwd filter:                         1  (1); expected 0.0 (1e-05)
Initial search space (Z):                  1  [actual number of targets]
Domain search space  (domZ):               1  [number of targets reported over threshold]
# CPU time: 0.02u 0.02s 00:00:00.04 Elapsed: 00:00:00.02
# Mc/sec: 10.83
//
[ok]

This GapMind analysis is from Apr 10 2024. The underlying query database was built on Apr 09 2024.

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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
changes to Amino acid biosynthesis since the publication.

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 Amino acid biosynthesis