2PKY

The Effect of Deuteration on Protein Structure A High Resolution Comparison of Hydrogenous and Perdeuterated Haloalkane Dehalogenase

Functional Information from GO Data

Chain	GOid	namespace	contents
X	0003824	molecular_function	catalytic activity
X	0009636	biological_process	response to toxic substance
X	0016787	molecular_function	hydrolase activity
X	0018786	molecular_function	haloalkane dehalogenase activity
X	0019260	biological_process	1,2-dichloroethane catabolic process

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	1
Details	ACT_SITE: Nucleophile

Chain	Residue	Details
X	ASP124

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site_id	SWS_FT_FI2
Number of Residues	1
Details	ACT_SITE: Proton donor

Chain	Residue	Details
X	ASP260

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site_id	SWS_FT_FI3
Number of Residues	1
Details	ACT_SITE: Proton acceptor

Chain	Residue	Details
X	HIS289

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site_id	SWS_FT_FI4
Number of Residues	1
Details	BINDING: BINDING => ECO:0000269|PubMed:10393294, ECO:0000269|PubMed:8515812

Chain	Residue	Details
X	TRP125

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site_id	SWS_FT_FI5
Number of Residues	1
Details	BINDING: BINDING => ECO:0000269|PubMed:10393294, ECO:0000269|PubMed:8515812, ECO:0007744|PDB:2DHD, ECO:0007744|PDB:2DHE

Chain	Residue	Details
X	TRP175

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Catalytic Information from CSA

site_id	CSA1
Number of Residues	3
Details	Annotated By Reference To The Literature 1b6g

Chain	Residue	Details
X	HIS289
X	ASP124
X	ASP260

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site_id	MCSA1
Number of Residues	5
Details	M-CSA 415

Chain	Residue	Details
X	ASP124	covalent catalysis
X	TRP125	electrostatic stabiliser
X	TRP175	electrostatic stabiliser
X	ASP260	activator, electrostatic stabiliser
X	HIS289	proton shuttle (general acid/base)

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