5ZH2

CRYSTAL STRUCTURE OF PfKRS WITH INHIBITOR CLADO-5

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000049	molecular_function	tRNA binding
A	0000166	molecular_function	nucleotide binding
A	0003676	molecular_function	nucleic acid binding
A	0003877	molecular_function	ATP:ADP adenylyltransferase activity
A	0004812	molecular_function	aminoacyl-tRNA ligase activity
A	0004824	molecular_function	lysine-tRNA ligase activity
A	0005524	molecular_function	ATP binding
A	0005615	cellular_component	extracellular space
A	0005634	cellular_component	nucleus
A	0005737	cellular_component	cytoplasm
A	0005739	cellular_component	mitochondrion
A	0005829	cellular_component	cytosol
A	0006418	biological_process	tRNA aminoacylation for protein translation
A	0006430	biological_process	lysyl-tRNA aminoacylation
A	0015966	biological_process	diadenosine tetraphosphate biosynthetic process
A	0017101	cellular_component	aminoacyl-tRNA synthetase multienzyme complex
A	0043032	biological_process	positive regulation of macrophage activation
B	0000049	molecular_function	tRNA binding
B	0000166	molecular_function	nucleotide binding
B	0003676	molecular_function	nucleic acid binding
B	0003877	molecular_function	ATP:ADP adenylyltransferase activity
B	0004812	molecular_function	aminoacyl-tRNA ligase activity
B	0004824	molecular_function	lysine-tRNA ligase activity
B	0005524	molecular_function	ATP binding
B	0005615	cellular_component	extracellular space
B	0005634	cellular_component	nucleus
B	0005737	cellular_component	cytoplasm
B	0005739	cellular_component	mitochondrion
B	0005829	cellular_component	cytosol
B	0006418	biological_process	tRNA aminoacylation for protein translation
B	0006430	biological_process	lysyl-tRNA aminoacylation
B	0015966	biological_process	diadenosine tetraphosphate biosynthetic process
B	0017101	cellular_component	aminoacyl-tRNA synthetase multienzyme complex
B	0043032	biological_process	positive regulation of macrophage activation

Functional Information from PDB Data

site_id	AC1
Number of Residues	10
Details	binding site for residue LYS A 601

Chain	Residue
A	GLY284
A	GLY552
A	ALA285
A	GLU308
A	ARG330
A	GLU346
A	TYR348
A	ASN503
A	TYR505
A	GLU507

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site_id	AC2
Number of Residues	11
Details	binding site for residue 9CU A 602

Chain	Residue
A	ARG330
A	GLU332
A	HIS338
A	ASN339
A	PHE342
A	GLU500
A	VAL501
A	LEU502
A	LEU555
A	ARG559
A	ILE570

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site_id	AC3
Number of Residues	1
Details	binding site for residue CL A 603

Chain	Residue
A	TRP349

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site_id	AC4
Number of Residues	3
Details	binding site for residue CL A 604

Chain	Residue
A	HIS338
A	LYS499
A	ARG559

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site_id	AC5
Number of Residues	4
Details	binding site for residue MPO A 605

Chain	Residue
A	GLN147
B	ARG81
B	LYS409
B	ASN412

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site_id	AC6
Number of Residues	11
Details	binding site for residue LYS B 601

Chain	Residue
B	GLY284
B	ALA285
B	GLU308
B	ARG330
B	GLU346
B	TYR348
B	ASN503
B	TYR505
B	GLU507
B	GLY552
B	GLY554

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site_id	AC7
Number of Residues	12
Details	binding site for residue 9CU B 602

Chain	Residue
B	ARG330
B	GLU332
B	HIS338
B	ASN339
B	PHE342
B	GLU500
B	VAL501
B	LEU502
B	GLY554
B	GLY556
B	ARG559
B	ILE570

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site_id	AC8
Number of Residues	1
Details	binding site for residue CL B 604

Chain	Residue
A	ARG108

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