3MCQ

Crystal structure of Thiamine-monophosphate kinase (Mfla_0573) from METHYLOBACILLUS FLAGELLATUS KT at 1.91 A resolution

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000287	molecular_function	magnesium ion binding
A	0005524	molecular_function	ATP binding
A	0009030	molecular_function	thiamine-phosphate kinase activity
A	0009228	biological_process	thiamine biosynthetic process
A	0009229	biological_process	thiamine diphosphate biosynthetic process
A	0016301	molecular_function	kinase activity
A	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE NA A 319

Chain	Residue
A	1PE328
A	HOH357

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site_id	AC2
Number of Residues	2
Details	BINDING SITE FOR RESIDUE NA A 320

Chain	Residue
A	PG4327
A	HOH400

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site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PEG A 321

Chain	Residue
A	ILE167
A	LEU178
A	GLY182
A	HIS186
A	PGE326

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site_id	AC4
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PEG A 322

Chain	Residue
A	GLN250
A	LEU307

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site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PEG A 323

Chain	Residue
A	ARG80
A	ASP111
A	ALA113

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site_id	AC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PEG A 324

Chain	Residue
A	ALA19
A	VAL23

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site_id	AC7
Number of Residues	1
Details	BINDING SITE FOR RESIDUE PGE A 325

Chain	Residue
A	LYS183

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site_id	AC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PGE A 326

Chain	Residue
A	ASP56
A	LEU59
A	GLN187
A	SER241
A	GLN245
A	PEG321

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site_id	AC9
Number of Residues	9
Details	BINDING SITE FOR RESIDUE PG4 A 327

Chain	Residue
A	ARG10
A	PHE12
A	ILE55
A	LEU59
A	LYS63
A	HIS186
A	ASP258
A	NA320
A	HOH400

---

site_id	BC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE 1PE A 328

Chain	Residue
A	LYS232
A	ALA233
A	ILE234
A	PRO235
A	GLU238
A	SER241
A	ASP284
A	ALA286
A	NA319

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