Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

2GGE

Crystal Structure of Mandelate Racemase/Muconate Lactonizing Enzyme from Bacillus Subtilis complexed with MG++ at 1.8 A

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000287	molecular_function	magnesium ion binding
A	0016052	biological_process	carbohydrate catabolic process
A	0016836	molecular_function	hydro-lyase activity
A	0016853	molecular_function	isomerase activity
A	0046872	molecular_function	metal ion binding
B	0000287	molecular_function	magnesium ion binding
B	0016052	biological_process	carbohydrate catabolic process
B	0016836	molecular_function	hydro-lyase activity
B	0016853	molecular_function	isomerase activity
B	0046872	molecular_function	metal ion binding
C	0000287	molecular_function	magnesium ion binding
C	0016052	biological_process	carbohydrate catabolic process
C	0016836	molecular_function	hydro-lyase activity
C	0016853	molecular_function	isomerase activity
C	0046872	molecular_function	metal ion binding
D	0000287	molecular_function	magnesium ion binding
D	0016052	biological_process	carbohydrate catabolic process
D	0016836	molecular_function	hydro-lyase activity
D	0016853	molecular_function	isomerase activity
D	0046872	molecular_function	metal ion binding
E	0000287	molecular_function	magnesium ion binding
E	0016052	biological_process	carbohydrate catabolic process
E	0016836	molecular_function	hydro-lyase activity
E	0016853	molecular_function	isomerase activity
E	0046872	molecular_function	metal ion binding
F	0000287	molecular_function	magnesium ion binding
F	0016052	biological_process	carbohydrate catabolic process
F	0016836	molecular_function	hydro-lyase activity
F	0016853	molecular_function	isomerase activity
F	0046872	molecular_function	metal ion binding
G	0000287	molecular_function	magnesium ion binding
G	0016052	biological_process	carbohydrate catabolic process
G	0016836	molecular_function	hydro-lyase activity
G	0016853	molecular_function	isomerase activity
G	0046872	molecular_function	metal ion binding
H	0000287	molecular_function	magnesium ion binding
H	0016052	biological_process	carbohydrate catabolic process
H	0016836	molecular_function	hydro-lyase activity
H	0016853	molecular_function	isomerase activity
H	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG H 400

Chain	Residue
H	GLU217
H	GLU243
H	HIS293
H	HOH402
H	HOH605
H	HOH626

site_id	AC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE MG G 400

Chain	Residue
G	HIS293
G	HOH1805
G	HOH1998
G	HOH2005
G	ASP190
G	GLU217
G	GLU243

site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG D 400

Chain	Residue
D	GLU217
D	GLU243
D	HIS293
D	HOH1847
D	HOH1878
D	HOH2026

site_id	AC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG C 400

Chain	Residue
C	GLU217
C	GLU243
C	HIS293
C	HOH587
C	HOH588
C	HOH589

site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG B 400

Chain	Residue
B	GLU217
B	GLU243
B	HIS293
B	HOH403
B	HOH628
B	HOH647

site_id	AC6
Number of Residues	7
Details	BINDING SITE FOR RESIDUE MG A 400

Chain	Residue
A	ASP190
A	GLU217
A	GLU243
A	HIS293
A	HOH618
A	HOH621
A	HOH622

site_id	AC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE MG F 400

Chain	Residue
F	ASP190
F	GLU217
F	GLU243
F	HIS293
F	HOH408
F	HOH445
F	HOH550

site_id	AC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE MG E 400

Chain	Residue
E	ASP190
E	GLU217
E	GLU243
E	HIS293
E	HOH465
E	HOH478
E	HOH535

site_id	AC9
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL D 1801

Chain	Residue
D	ALA373
D	GLY376

site_id	BC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL D 1802

Chain	Residue
D	TRP54
D	TYR374

site_id	BC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL G 1803

Chain	Residue
G	GLN193
G	ASN244
G	HOH1833

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	16
Details	ACT_SITE: ACT_SITE => ECO:0000250

Chain	Residue	Details
A	LYS161
E	HIS293
F	LYS161
F	HIS293
G	LYS161
G	HIS293
H	LYS161
H	HIS293
A	HIS293
B	LYS161
B	HIS293
C	LYS161
C	HIS293
D	LYS161
D	HIS293
E	LYS161

site_id	SWS_FT_FI2
Number of Residues	24
Details	BINDING:

Chain	Residue	Details
A	GLU217
D	GLU217
D	GLU243
D	HIS293
E	GLU217
E	GLU243
E	HIS293
F	GLU217
F	GLU243
F	HIS293
G	GLU217
A	GLU243
G	GLU243
G	HIS293
H	GLU217
H	GLU243
H	HIS293
A	HIS293
B	GLU217
B	GLU243
B	HIS293
C	GLU217
C	GLU243
C	HIS293

Catalytic Information from CSA

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

Chain	Residue	Details
A	ASP320
A	LYS161
A	LYS159

site_id	CSA10
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
B	GLU323
B	ASP266
B	HIS293
B	LYS161

site_id	CSA11
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
C	GLU323
C	ASP266
C	HIS293
C	LYS161

site_id	CSA12
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
D	GLU323
D	ASP266
D	HIS293
D	LYS161

site_id	CSA13
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
E	GLU323
E	ASP266
E	HIS293
E	LYS161

site_id	CSA14
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
F	GLU323
F	ASP266
F	HIS293
F	LYS161

site_id	CSA15
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
G	GLU323
G	ASP266
G	HIS293
G	LYS161

site_id	CSA16
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
H	GLU323
H	ASP266
H	HIS293
H	LYS161

site_id	CSA2
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
B	ASP320
B	LYS161
B	LYS159

site_id	CSA3
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
C	ASP320
C	LYS161
C	LYS159

site_id	CSA4
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
D	ASP320
D	LYS161
D	LYS159

site_id	CSA5
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
E	ASP320
E	LYS161
E	LYS159

site_id	CSA6
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
F	ASP320
F	LYS161
F	LYS159

site_id	CSA7
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
G	ASP320
G	LYS161
G	LYS159

site_id	CSA8
Number of Residues	3
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
H	ASP320
H	LYS161
H	LYS159

site_id	CSA9
Number of Residues	4
Details	Annotated By Reference To The Literature 1mdr

Chain	Residue	Details
A	GLU323
A	ASP266
A	HIS293
A	LYS161

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)