7TLI

THERMOLYSIN (90% ISOPROPANOL SOAKED CRYSTALS)

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004222	molecular_function	metalloendopeptidase activity
A	0006508	biological_process	proteolysis

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN A 401

Chain	Residue
A	HIS142
A	HIS146
A	GLU166
A	HOH1001
A	HOH1002

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site_id	AC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CA A 402

Chain	Residue
A	GLU190
A	HOH1014
A	ASP138
A	GLU177
A	ASP185
A	GLU187

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site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CA A 403

Chain	Residue
A	GLU177
A	ASN183
A	ASP185
A	GLU190
A	HOH1013
A	HOH1030

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site_id	AC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CA A 404

Chain	Residue
A	ASP57
A	ASP59
A	GLN61
A	HOH1016
A	HOH1027
A	HOH1047

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site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CA A 405

Chain	Residue
A	TYR193
A	THR194
A	ILE197
A	ASP200
A	HOH1038
A	HOH1065

---

site_id	AC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE DMS A 2000

Chain	Residue
A	SER218
A	TYR251

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site_id	AC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE IPA A 2001

Chain	Residue
A	ASN112
A	GLU143
A	HOH1001
A	HOH1002
A	HOH1067
A	HOH1117

---

site_id	AC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE IPA A 2002

Chain	Residue
A	TYR81
A	TYR84
A	SER92
A	TYR93
A	VAL148
A	HOH1021

---

site_id	AC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE IPA A 2003

Chain	Residue
A	LEU202
A	TYR211
A	ASP213

---

site_id	BC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE IPA A 2004

Chain	Residue
A	HIS216
A	ASP311
A	ALA312
A	GLY314
A	LYS316

---

site_id	BC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE IPA A 2005

Chain	Residue
A	THR48
A	TYR106
A	TRP115
A	GLY117
A	ASP150
A	TYR157

---

site_id	BC3
Number of Residues	1
Details	BINDING SITE FOR RESIDUE IPA A 2006

Chain	Residue
A	SER5

---

site_id	BC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE IPA A 2007

Chain	Residue
A	ILE1
A	ALA209
A	GLY212
A	HOH1086

---

site_id	BC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE IPA A 2008

Chain	Residue
A	PHE114
A	TRP115
A	GLU143

---

Functional Information from PROSITE/UniProt

site_id	PS00142
Number of Residues	10
Details	ZINC_PROTEASE Neutral zinc metallopeptidases, zinc-binding region signature. VVAHELTHAV

Chain	Residue	Details
A	VAL139-VAL148

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	1
Details	Active site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU10095","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"4808703","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

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site_id	SWS_FT_FI2
Number of Residues	1
Details	Active site: {"description":"Proton donor","evidences":[{"source":"PROSITE-ProRule","id":"PRU10095","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"4808703","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	16
Details	Binding site: {}

Chain

Residue

Details

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Catalytic Information from CSA

site_id	CSA1
Number of Residues	2
Details	Annotated By Reference To The Literature 1tlp

Chain	Residue	Details
A	HIS231
A	GLU143

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site_id	MCSA1
Number of Residues	7
Details	M-CSA 176

Chain	Residue	Details
A	HIS142	metal ligand
A	GLU143	electrostatic stabiliser, metal ligand
A	HIS146	metal ligand
A	TYR157	electrostatic stabiliser, hydrogen bond donor, steric role
A	GLU166	metal ligand
A	ASP226	activator, electrostatic stabiliser, hydrogen bond acceptor
A	HIS231	hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor

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