2a3a

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Crystal structure of Aspergillus fumigatus chitinase B1 in complex with theophylline

Authors	Rao, F.V. Andersen, O.A. Vora, K.A. Demartino, J.A. van Aalten, D.M.
Citation	Methylxanthine drugs are chitinase inhibitors: investigation of inhibition and binding modes. PubMed
Release date	2005-09-27
Exp. Method	X-RAY DIFFRACTION
Resolution	2.1 Å
Classification	HYDROLASE

Sequence

Chain(s) A B (433 residues): Blast Uniprot EC 3.2.1.14

MRFATSTIVKVALLLSSLCVDAAVMWNRDTSSTDLEARASSGYRSVVYFVNWAIYGRNHNPQDLPVERLTHVLYAFANVR
PETGEVYMTDSWADIEKHYPGDSWSDTGNNVYGCIKQLYLLKKQNRNLKVLLSIGGWTYSPNFAPAASTDAGRKNFAKTA
VKLLQDLGFDGLDIDWEYPENDQQANDFVLLLKEVRTALDSYSAANAGGQHFLLTVASPAGPDKIKVLHLKDMDQQLDFW
NLMAYDYAGSFSSLSGHQANVYNDTSNPLSTPFNTQTALDLYRAGGVPANKIVLGMPLYGRSFANTDGPGKPYNGVGQGS
WENGVWDYKALPQAGATEHVLPDIMASYSYDATNKFLISYDNPQVANLKSGYIKSLGLGGAMWWDSSSDKTGSDSLITTV
VNALGGTGVFEQSQNELDYPVSQYDNLRNGMQT