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PETase ANnotation and Triage System

Nature's solution to a human-made problem, and structural learnings from Nature

PANTS-0d18adef6bca

Human gut 330 aa · assembly ERZ4561292_FASTA_predicted_cds · contig ERZ4561292.54438-Hadza-MoBio-hadza-A-D-D-16-1621--NODE-54438-length-4281-cov-3.203378_3

Retrieval

E-value2.30e-10
Bitscore27.7
Identity to nearest0.295
Nearest characterisedEC:A0ABV5TJR7

Structure

Methodesmfold
Mean pLDDT92.1
RMSD to IsPETase22.47 Å
Aligned fraction0.223

Aligned fraction is a length-normalised gemmi superposition statistic, not a true TM-score.

Active site

TriadS136/D186/H218
Ser–His2.95 Å
His–Asp3.04 Å
Cleft width23.02 Å
Cleft depth4.41 Å

Aromatic clamp: PHE143, PHE181, PHE193, PHE219, PHE77, PHE95, TRP105, TYR102, TYR58

Structure, superposed on IsPETase

Catalytic triad drawn as ball-and-stick from the measured residues.

Sequence

MRKIKIFIIFALLIISSVPTAWASGCTFEPHTFYGKEKIDYYLFTPQNATENMPLIVYLHGGSGKGDNIEKLTENGFCMWVKEGKFDGTPAYILFPQLSSKYKGWSDAKNLLKELINNVTDTYAINPNRISLTGHSMGGTGTFAVASAYPGMFSCVVPMSGSIQLTDENLDAFSSLPVWAFVGSADTIVSPSFSEEFVAALKENGCDARLTVFEGADHFSVPELAYLNENLDVVGYLTSHSKSNKITDCTDGTVSITAQLPGEYSLITARRTQGGTEQIKLTHVTVAYGKNTIPISDFDIQNGDEIMLWKDLKPIAKKYTVGQATGRKGE