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PETase ANnotation and Triage System

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

PANTS-815d14b44812

Compost 361 aa · assembly ERZ10545954_FASTA_predicted_cds · contig ERZ10545954.9493-NODE-9494-length-2296-cov-3.385096_2

Retrieval

E-value3.20e-11
Bitscore30.5
Identity to nearest0.328
Nearest characterisedEC:A0ABP8Q6M0

Structure

Methodesmfold
Mean pLDDT89.1
RMSD to IsPETase12.52 Å
Aligned fraction0.268

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

Active site

TriadS183/D241/H270
Ser–His2.96 Å
His–Asp3.46 Å
Cleft width24.95 Å
Cleft depth1.53 Å

Aromatic clamp: PHE147, PHE184, PHE253, PHE273, PHE283, PHE284, PHE293, PHE84, PHE88, TRP187, TRP215, TYR145, TYR235

Structure, superposed on IsPETase

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

Sequence

MPDFFQRGPHPVGVATRELADPGRNGRRITVEVWYPADAAHAGADCAKASQDEYPLFGGYRVRQEAVRDASPWRDPRPRPCVLFSHGFAGHRRQSTFFTTHLASHGYLVIAPDHAGNTMVDIMNLALSLGPGRMPSDPETLLGSYAFDRPRDVGLCIDACSRGEFEVLAPVDLASGVAVTGHSFGGWTSLVVAGRDPRVRAVLAMAPAGGPGPLWALALERELTFEFAPGVDTLYLAAARDTLLPLTGIEQMFLRTPDPVRKFVLENADHMHFCDSVERSHEFFRSMPPLGPFAAVAKRTPPMSELVPGALGHLFINGLGTAHLDAVLRGDPEGAEFLANGVAQLAAQGVEAREVTREHRI