GapMind for Amino acid biosynthesis

 

Aligments for a candidate for leuD in Acidovorax sp. GW101-3H11

Align 3-isopropylmalate dehydratase subunit LeuD (EC 4.2.1.33) (characterized)
to candidate Ac3H11_1527 3-isopropylmalate dehydratase small subunit (EC 4.2.1.33)

Query= ecocyc::LEUD-MONOMER
         (201 letters)



>lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527 3-isopropylmalate
           dehydratase small subunit (EC 4.2.1.33)
          Length = 221

 Score =  232 bits (591), Expect = 4e-66
 Identities = 117/210 (55%), Positives = 149/210 (70%), Gaps = 15/210 (7%)

Query: 3   EKFIKHTGLVVPLDAANVDTDAIIPKQFLQKVTRTGFGAHLFNDWRFLD-------EKGQ 55
           +KF  H GLV P+D  NVDTDAIIPKQFL+ + +TGFG +LF++WR+LD       E  +
Sbjct: 2   QKFTVHKGLVAPMDRENVDTDAIIPKQFLKSIKKTGFGPNLFDEWRYLDKGEPGIPESAR 61

Query: 56  QPNPDFVLNFPQYQGASILLARENFGCGSSREHAPWALTDYGFKVVIAPSFADIFYGNSF 115
           +PNPDFVLN P+Y+GASIL+AR+NFGCGSSREHAPWAL  +GF+ VIAPSFADIF+ N F
Sbjct: 62  KPNPDFVLNLPRYKGASILIARKNFGCGSSREHAPWALDQFGFRAVIAPSFADIFFNNCF 121

Query: 116 NNQLLPVKLSDAEVDELFALVKANPGIHFDVDLEAQEV-------KAGEKTYRFTIDAFR 168
            N LLP+ L +A V +LF  V A PG    +DLE Q V         GE+   F + AFR
Sbjct: 122 KNGLLPIVLPEATVAQLFDEVAAFPGYQLTIDLERQVVVRQNRDEVVGEE-IPFDVIAFR 180

Query: 169 RHCMMNGLDSIGLTLQHDDAIAAYEAKQPA 198
           ++C++NG D IGLTL+  D I A+EA++ A
Sbjct: 181 KYCLLNGFDDIGLTLRKSDKIRAFEAERLA 210


Lambda     K      H
   0.322    0.138    0.421 

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: 189
Number of extensions: 6
Number of successful extensions: 3
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: 201
Length of database: 221
Length adjustment: 21
Effective length of query: 180
Effective length of database: 200
Effective search space:    36000
Effective search space used:    36000
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 (21.9 bits)
S2: 45 (21.9 bits)

Align candidate Ac3H11_1527 (3-isopropylmalate dehydratase small subunit (EC 4.2.1.33))
to HMM TIGR00171 (leuD: 3-isopropylmalate dehydratase, small subunit (EC 4.2.1.33))

# 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/TIGR00171.hmm
# target sequence database:        /tmp/gapView.7539.genome.faa
# - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -

Query:       TIGR00171  [M=188]
Accession:   TIGR00171
Description: leuD: 3-isopropylmalate dehydratase, small subunit
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
    ------- ------ -----    ------- ------ -----   ---- --  --------                                        -----------
    8.5e-83  262.9   0.0    9.9e-83  262.6   0.0    1.0  1  lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527  3-isopropylmalate dehydratase sm


Domain annotation for each sequence (and alignments):
>> lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527  3-isopropylmalate dehydratase small subunit (EC 4.2.1.33)
   #    score  bias  c-Evalue  i-Evalue hmmfrom  hmm to    alifrom  ali to    envfrom  env to     acc
 ---   ------ ----- --------- --------- ------- -------    ------- -------    ------- -------    ----
   1 !  262.6   0.0   9.9e-83   9.9e-83       1     188 []       1     201 [.       1     201 [. 0.92

  Alignments for each domain:
  == domain 1  score: 262.6 bits;  conditional E-value: 9.9e-83
                                        TIGR00171   1 mkefkkltGlvvpldkanvdtdaiipkqflkkikrtGfgkhlfyewryld.......ekGke 55 
                                                      m++f  ++Glv+p+d+ nvdtdaiipkqflk ik+tGfg +lf ewryld       e  ++
  lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527   1 MQKFTVHKGLVAPMDRENVDTDAIIPKQFLKSIKKTGFGPNLFDEWRYLDkgepgipESARK 62 
                                                      899**********************************************9333333335689 PP

                                        TIGR00171  56 pnpefvlnvpqyqgasillarenfGcGssrehapwalkdyGfkviiapsfadifynnsfkng 117
                                                      pnp+fvln p+y+gasil+ar+nfGcGssrehapwal+++Gf+ +iapsfadif+nn+fkng
  lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527  63 PNPDFVLNLPRYKGASILIARKNFGCGSSREHAPWALDQFGFRAVIAPSFADIFFNNCFKNG 124
                                                      ************************************************************** PP

                                        TIGR00171 118 llpirlseeeveellalvk.nkglkltvdleaqkvkdseg.....kvysfeidefrkhclln 173
                                                      llpi l+e++v +l+  v+  +g +lt+dle q v   +      + + f++ +frk clln
  lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527 125 LLPIVLPEATVAQLFDEVAaFPGYQLTIDLERQVVVRQNRdevvgEEIPFDVIAFRKYCLLN 186
                                                      ******************989************9976553223338899************* PP

                                        TIGR00171 174 Gldeigltlqkedei 188
                                                      G+d+igltl+k d+i
  lcl|FitnessBrowser__acidovorax_3H11:Ac3H11_1527 187 GFDDIGLTLRKSDKI 201
                                                      *************98 PP



Internal pipeline statistics summary:
-------------------------------------
Query model(s):                            1  (188 nodes)
Target sequences:                          1  (221 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: 0.01u 0.00s 00:00:00.01 Elapsed: 00:00:00.00
# Mc/sec: 9.25
//
[ok]

This GapMind analysis is from Aug 03 2021. The underlying query database was built on Aug 03 2021.

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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:

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:

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:

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 preprint on GapMind for carbon sources, or view the source code, or see 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