1P73

Crystal structure of EHV4-TK complexed with TP4A

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004797	molecular_function	thymidine kinase activity
A	0005524	molecular_function	ATP binding
A	0006230	biological_process	TMP biosynthetic process
A	0009157	biological_process	deoxyribonucleoside monophosphate biosynthetic process
A	0016301	molecular_function	kinase activity
A	0071897	biological_process	DNA biosynthetic process
B	0004797	molecular_function	thymidine kinase activity
B	0005524	molecular_function	ATP binding
B	0006230	biological_process	TMP biosynthetic process
B	0009157	biological_process	deoxyribonucleoside monophosphate biosynthetic process
B	0016301	molecular_function	kinase activity
B	0071897	biological_process	DNA biosynthetic process
C	0004797	molecular_function	thymidine kinase activity
C	0005524	molecular_function	ATP binding
C	0006230	biological_process	TMP biosynthetic process
C	0009157	biological_process	deoxyribonucleoside monophosphate biosynthetic process
C	0016301	molecular_function	kinase activity
C	0071897	biological_process	DNA biosynthetic process
D	0004797	molecular_function	thymidine kinase activity
D	0005524	molecular_function	ATP binding
D	0006230	biological_process	TMP biosynthetic process
D	0009157	biological_process	deoxyribonucleoside monophosphate biosynthetic process
D	0016301	molecular_function	kinase activity
D	0071897	biological_process	DNA biosynthetic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 601

Chain	Residue
A	PHE69
A	GLU70
A	THR71
A	ARG104
A	HOH828
B	SER159

---

site_id	AC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 A 602

Chain	Residue
A	ARG172
A	PRO174
A	GLN175

---

site_id	AC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 A 603

Chain	Residue
A	ARG127
A	LEU330
A	HOH826
B	GLN202

---

site_id	AC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 B 604

Chain	Residue
A	SER159
A	CYS161
A	GLU275
B	THR71
B	ARG104

---

site_id	AC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 A 605

Chain	Residue
A	ARG232
A	GLY234
A	TRP235
A	GLY236
A	GLU237

---

site_id	AC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 B 606

Chain	Residue
A	ARG172
B	ARG172

---

site_id	AC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 B 607

Chain	Residue
B	ARG172
B	PRO174
B	GLN175

---

site_id	AC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 B 608

Chain	Residue
B	ARG313
B	GLN314

---

site_id	AC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 C 609

Chain	Residue
C	PHE69
C	GLU70
C	THR71
C	ARG104
C	HOH826
C	HOH828
D	SER159

---

site_id	BC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 C 610

Chain	Residue
C	ARG127
C	LEU330
D	GLN202

---

site_id	BC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 611

Chain	Residue
C	SER159
D	GLU70
D	THR71
D	ARG104

---

site_id	BC3
Number of Residues	19
Details	BINDING SITE FOR RESIDUE 4TA A 801

Chain	Residue
A	TYR34
A	GLY35
A	ILE36
A	GLY37
A	LYS38
A	SER39
A	THR40
A	GLU60
A	GLN102
A	PHE105
A	ARG139
A	SER144
A	PHE148
A	ARG192
A	ARG196
A	GLY310
A	THR311
A	PRO312
C	THR195

---

site_id	BC4
Number of Residues	20
Details	BINDING SITE FOR RESIDUE 4TA B 802

Chain	Residue
B	TYR34
B	GLY35
B	ILE36
B	GLY37
B	LYS38
B	SER39
B	THR40
B	GLU60
B	TYR78
B	GLN102
B	PHE105
B	ARG139
B	SER144
B	PHE148
B	ARG192
B	ARG196
B	GLY310
B	THR311
B	PRO312
B	HOH831

---

site_id	BC5
Number of Residues	20
Details	BINDING SITE FOR RESIDUE 4TA C 803

Chain	Residue
C	GLY310
C	THR311
C	PRO312
C	CYS315
C	TYR34
C	GLY35
C	ILE36
C	GLY37
C	LYS38
C	SER39
C	THR40
C	GLU60
C	TRP65
C	TYR78
C	GLN102
C	PHE105
C	ARG139
C	SER144
C	PHE148
C	ARG192

---

site_id	BC6
Number of Residues	19
Details	BINDING SITE FOR RESIDUE 4TA D 804

Chain	Residue
D	TYR34
D	GLY35
D	GLY37
D	LYS38
D	SER39
D	THR40
D	GLU60
D	TYR78
D	GLN102
D	PHE105
D	ARG139
D	SER144
D	PHE148
D	ARG192
D	ARG196
D	GLY310
D	THR311
D	PRO312
D	CYS315

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	4
Details	ACT_SITE: Proton acceptor => ECO:0000255|HAMAP-Rule:MF_04029

Chain	Residue	Details
A	GLU60
B	GLU60
C	GLU60
D	GLU60

---

site_id	SWS_FT_FI2
Number of Residues	16
Details	BINDING: BINDING => ECO:0000255|HAMAP-Rule:MF_04029, ECO:0000269|PubMed:14527394, ECO:0007744|PDB:1P72

Chain	Residue	Details
A	GLY32
C	TYR78
C	GLN102
C	ARG192
D	GLY32
D	TYR78
D	GLN102
D	ARG192
A	TYR78
A	GLN102
A	ARG192
B	GLY32
B	TYR78
B	GLN102
B	ARG192
C	GLY32

---

site_id	SWS_FT_FI3
Number of Residues	8
Details	BINDING: BINDING => ECO:0000269|PubMed:14527394, ECO:0007744|PDB:1P72

Chain	Residue	Details
A	PHE105
A	PHE148
B	PHE105
B	PHE148
C	PHE105
C	PHE148
D	PHE105
D	PHE148

---

site_id	SWS_FT_FI4
Number of Residues	4
Details	BINDING: BINDING => ECO:0000255|HAMAP-Rule:MF_04029

Chain	Residue	Details
A	ARG198
B	ARG198
C	ARG198
D	ARG198

---

Catalytic Information from CSA

site_id	CSA1
Number of Residues	4
Details	Annotated By Reference To The Literature 1kim

Chain	Residue	Details
A	GLY35
A	ARG198
A	GLU60
A	ARG139

---

site_id	CSA2
Number of Residues	4
Details	Annotated By Reference To The Literature 1kim

Chain	Residue	Details
B	GLY35
B	ARG198
B	GLU60
B	ARG139

---

site_id	CSA3
Number of Residues	4
Details	Annotated By Reference To The Literature 1kim

Chain	Residue	Details
C	GLY35
C	ARG198
C	GLU60
C	ARG139

---

site_id	CSA4
Number of Residues	4
Details	Annotated By Reference To The Literature 1kim

Chain	Residue	Details
D	GLY35
D	ARG198
D	GLU60
D	ARG139

---