Alignments for a candidate for ilvD in Thermocrinis albus DSM 14484

GapMind for Amino acid biosynthesis

Alignments for a candidate for ilvD in Thermocrinis albus DSM 14484

Align dihydroxy-acid dehydratase subunit (EC 4.2.1.9) (characterized)
to candidate WP_012992424.1 THAL_RS07050 dihydroxy-acid dehydratase

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



>NCBI__GCF_000025605.1:WP_012992424.1
          Length = 554

 Score =  589 bits (1519), Expect = e-173
 Identities = 298/555 (53%), Positives = 398/555 (71%), Gaps = 10/555 (1%)

Query: 1   MKSDTIKRGIQRAPHRSLLARCGLTDDDFEKPFIGIANSYTDIVPGHIHLRELAEAVKEG 60
           M+SD +K+G++RAPHR+LL  CGLTD+D +KP IGIANSY DI+PGH+HLRE  E +KE 
Sbjct: 1   MRSDKVKKGVERAPHRALLRACGLTDEDMDKPLIGIANSYIDIIPGHVHLREFVEPIKEE 60

Query: 61  VNAAGGVAFEFNTMAICDGIAMNHDGMKYSLASREIVADTVESMAMAHALDGLVLLPTCD 120
           V  AGGV  EFN + + DGIAM H GM YSL SRE++AD++E++  AH LD L+ +P CD
Sbjct: 61  VRKAGGVPIEFNVIGVDDGIAMGHYGMHYSLPSRELIADSIETVVEAHQLDALICIPNCD 120

Query: 121 KIVPGMLMAAARLDIPAIVVTGGPMLPGEFKGRKVDLINVYEGVGTVSAGEMSEDELEEL 180
           KIVPGMLMAA RL+IP I ++GGPML GE +G+KVDLI V+EG+G + AG++ E +L+ L
Sbjct: 121 KIVPGMLMAAVRLNIPTIFISGGPMLAGELEGQKVDLITVFEGIGQLKAGKIDEAKLKLL 180

Query: 181 ERCACPGPRSCAGLFTANTMACLTEALGMSLPGCATAHAVSSRKRQIARLSGKRIVEMVQ 240
           E+ ACP   SC+G+FTAN+M CLTE LG+ LPG  T  AV  R+  +AR + ++I+E+++
Sbjct: 181 EQTACPTCGSCSGMFTANSMNCLTEVLGLGLPGNGTIPAVDPRREMLARQAARQIMELLK 240

Query: 241 ENLKPTMIMSQEAFENAVMVDLALGGSTNTTLHIPAIAAEIDGLNINLDLFDELSRVIPH 300
            +++P  I++ EA +NA  VD+A+GGSTNT LH+ AIA E  G++  L+  D +S+  P 
Sbjct: 241 RDIRPRDIVTVEALDNAFAVDIAMGGSTNTVLHLLAIAQEA-GIDYPLERIDRISKATPT 299

Query: 301 IASISPAGEHMMLDLDRAGGIPAVLKTL-----EDHINRECVTCTGRTVQENIENVKVGH 355
           +  ISPA  + + DLD  GGIPA+LK L       H +R  V+   +T++E   +     
Sbjct: 300 LCKISPASHYHIQDLDMVGGIPALLKELIRGNYLPHPDRPTVSL--KTLREIAMSAPDAD 357

Query: 356 RDVIRPLDSPVHSEGGLAILRGNLAPRGSVVKQGAVAEDMMVHEGPAKVFNSEDECMEAI 415
            +VIR ++ P   +GGLAIL GNLAP G+VVK   V+E+M+V  G A  F+SE+E +EAI
Sbjct: 358 GEVIRRIEEPYSRDGGLAILFGNLAPEGAVVKTAGVSENMLVFRGKAICFDSEEEAVEAI 417

Query: 416 FGGRIDEGDVIVIRYEGPKGGPGMREMLNPTSAIAGMGL-ERVALITDGRFSGGTRGPCV 474
            GGR+  G V+VIRYEGPKGGPGMREML+PTSAI GMGL ++VALITDGRFSGGTRG CV
Sbjct: 418 LGGRVKPGHVVVIRYEGPKGGPGMREMLSPTSAIMGMGLGDKVALITDGRFSGGTRGACV 477

Query: 475 GHVSPEAMEDGPLAAVNDGDIIRIDIPSRKLEVDLSPREIEERLQSAVKPRRSVKG-WLA 533
           GH+SPEA   GP+  V DGD I IDIP R++E+ +   E++ RL+  V  ++ +K  WL 
Sbjct: 478 GHISPEAAAGGPIGVVKDGDEILIDIPGRRIELLIPEEELQRRLKEFVPKQKEIKSRWLR 537

Query: 534 RYRKLAGSADTGAVL 548
           RY +   SA  GAVL
Sbjct: 538 RYVRFVTSASKGAVL 552


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: 1012
Number of extensions: 51
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: 554
Length adjustment: 36
Effective length of query: 513
Effective length of database: 518
Effective search space:   265734
Effective search space used:   265734
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_012992424.1 THAL_RS07050 (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.26636.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
    ------- ------ -----    ------- ------ -----   ---- --  --------                                 -----------
   1.3e-253  828.4   0.3   1.4e-253  828.2   0.3    1.0  1  lcl|NCBI__GCF_000025605.1:WP_012992424.1  THAL_RS07050 dihydroxy-acid dehy


Domain annotation for each sequence (and alignments):
>> lcl|NCBI__GCF_000025605.1:WP_012992424.1  THAL_RS07050 dihydroxy-acid dehydratase
   #    score  bias  c-Evalue  i-Evalue hmmfrom  hmm to    alifrom  ali to    envfrom  env to     acc
 ---   ------ ----- --------- --------- ------- -------    ------- -------    ------- -------    ----
   1 !  828.2   0.3  1.4e-253  1.4e-253       1     542 [.      14     553 ..      14     554 .] 0.99

  Alignments for each domain:
  == domain 1  score: 828.2 bits;  conditional E-value: 1.4e-253
                                 TIGR00110   1 aarallkatGlkdedlekPiiavvnsyteivPghvhlkdlaklvkeeieaaGgvakefntiavsDGiam 69 
                                               ++rall+a+Gl+ded++kP+i+++nsy++i+Pghvhl+++ + +kee+++aGgv+ efn+i+v+DGiam
  lcl|NCBI__GCF_000025605.1:WP_012992424.1  14 PHRALLRACGLTDEDMDKPLIGIANSYIDIIPGHVHLREFVEPIKEEVRKAGGVPIEFNVIGVDDGIAM 82 
                                               69******************************************************************* PP

                                 TIGR00110  70 gheGmkysLpsreiiaDsvetvvkahalDalvvissCDkivPGmlmaalrlniPaivvsGGpmeagktk 138
                                               gh Gm+ysLpsre+iaDs+etvv+ah+lDal++i++CDkivPGmlmaa+rlniP+i++sGGpm ag+++
  lcl|NCBI__GCF_000025605.1:WP_012992424.1  83 GHYGMHYSLPSRELIADSIETVVEAHQLDALICIPNCDKIVPGMLMAAVRLNIPTIFISGGPMLAGELE 151
                                               ********************************************************************* PP

                                 TIGR00110 139 lsekidlvdvfeavgeyaagklseeeleeiersacPtagsCsGlftansmacltealGlslPgsstlla 207
                                                ++k+dl+ vfe++g+ +agk++e++l+ +e++acPt+gsCsG+ftansm+clte+lGl lPg++t++a
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 152 -GQKVDLITVFEGIGQLKAGKIDEAKLKLLEQTACPTCGSCSGMFTANSMNCLTEVLGLGLPGNGTIPA 219
                                               .9******************************************************************* PP

                                 TIGR00110 208 tsaekkelakksgkrivelvkknikPrdiltkeafenaitldlalGGstntvLhllaiakeagvklsld 276
                                               ++ +++ la++++++i+el+k++i+Prdi+t ea++na+++d+a+GGstntvLhllaia+eag+++ l+
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 220 VDPRREMLARQAARQIMELLKRDIRPRDIVTVEALDNAFAVDIAMGGSTNTVLHLLAIAQEAGIDYPLE 288
                                               ********************************************************************* PP

                                 TIGR00110 277 dfdrlsrkvPllaklkPsgkkviedlhraGGvsavlkeldkegll.hkdaltvtGktlaetlekvkvlr 344
                                               ++dr+s+ +P+l+k++P++++ i+dl+ +GG++a+lkel + ++l h d  tv+ ktl e++ +++   
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 289 RIDRISKATPTLCKISPASHYHIQDLDMVGGIPALLKELIRGNYLpHPDRPTVSLKTLREIAMSAPDA- 356
                                               *****************************************8887689****************9999. PP

                                 TIGR00110 345 vdqdvirsldnpvkkegglavLkGnlaeeGavvkiagveedilkfeGpakvfeseeealeailggkvke 413
                                                d +vir +++p++++ggla+L+Gnla+eGavvk+agv+e++l+f+G+a  f+seeea+eailgg+vk 
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 357 -DGEVIRRIEEPYSRDGGLAILFGNLAPEGAVVKTAGVSENMLVFRGKAICFDSEEEAVEAILGGRVKP 424
                                               .******************************************************************** PP

                                 TIGR00110 414 GdvvviryeGPkGgPGmremLaPtsalvglGLgkkvaLitDGrfsGgtrGlsiGhvsPeaaegGaialv 482
                                               G+vvviryeGPkGgPGmremL Ptsa++g+GLg+kvaLitDGrfsGgtrG ++Gh+sPeaa+gG+i++v
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 425 GHVVVIRYEGPKGGPGMREMLSPTSAIMGMGLGDKVALITDGRFSGGTRGACVGHISPEAAAGGPIGVV 493
                                               ********************************************************************* PP

                                 TIGR00110 483 edGDkikiDienrkldlevseeelaerrakakkkearevkgaLakyaklvssadkGavld 542
                                               +dGD+i iDi+ r+++l + eeel++r ++ ++k+++ ++ +L++y ++v+sa+kGavl+
  lcl|NCBI__GCF_000025605.1:WP_012992424.1 494 KDGDEILIDIPGRRIELLIPEEELQRRLKEFVPKQKEIKSRWLRRYVRFVTSASKGAVLE 553
                                               ***********************************99999******************86 PP



Internal pipeline statistics summary:
-------------------------------------
Query model(s):                            1  (543 nodes)
Target sequences:                          1  (554 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 0.01s 00:00:00.03 Elapsed: 00:00:00.04
# Mc/sec: 7.48
//
[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