5I7O

Mycobacterium tuberculosis CysM in complex with the Urea-scaffold inhibitor 7 [3-(3-(4-Chlorophenyl)ureido)benzoic acid]

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004124	molecular_function	cysteine synthase activity
A	0005515	molecular_function	protein binding
A	0005737	cellular_component	cytoplasm
A	0005829	cellular_component	cytosol
A	0006535	biological_process	cysteine biosynthetic process from serine
A	0008652	biological_process	amino acid biosynthetic process
A	0016740	molecular_function	transferase activity
A	0016765	molecular_function	transferase activity, transferring alkyl or aryl (other than methyl) groups
A	0019344	biological_process	cysteine biosynthetic process
A	0030170	molecular_function	pyridoxal phosphate binding
A	0032991	cellular_component	protein-containing complex
A	0033847	molecular_function	O-phosphoserine sulfhydrylase activity
B	0004124	molecular_function	cysteine synthase activity
B	0005515	molecular_function	protein binding
B	0005737	cellular_component	cytoplasm
B	0005829	cellular_component	cytosol
B	0006535	biological_process	cysteine biosynthetic process from serine
B	0008652	biological_process	amino acid biosynthetic process
B	0016740	molecular_function	transferase activity
B	0016765	molecular_function	transferase activity, transferring alkyl or aryl (other than methyl) groups
B	0019344	biological_process	cysteine biosynthetic process
B	0030170	molecular_function	pyridoxal phosphate binding
B	0032991	cellular_component	protein-containing complex
B	0033847	molecular_function	O-phosphoserine sulfhydrylase activity
C	0004124	molecular_function	cysteine synthase activity
C	0005515	molecular_function	protein binding
C	0005737	cellular_component	cytoplasm
C	0005829	cellular_component	cytosol
C	0006535	biological_process	cysteine biosynthetic process from serine
C	0008652	biological_process	amino acid biosynthetic process
C	0016740	molecular_function	transferase activity
C	0016765	molecular_function	transferase activity, transferring alkyl or aryl (other than methyl) groups
C	0019344	biological_process	cysteine biosynthetic process
C	0030170	molecular_function	pyridoxal phosphate binding
C	0032991	cellular_component	protein-containing complex
C	0033847	molecular_function	O-phosphoserine sulfhydrylase activity
D	0004124	molecular_function	cysteine synthase activity
D	0005515	molecular_function	protein binding
D	0005737	cellular_component	cytoplasm
D	0005829	cellular_component	cytosol
D	0006535	biological_process	cysteine biosynthetic process from serine
D	0008652	biological_process	amino acid biosynthetic process
D	0016740	molecular_function	transferase activity
D	0016765	molecular_function	transferase activity, transferring alkyl or aryl (other than methyl) groups
D	0019344	biological_process	cysteine biosynthetic process
D	0030170	molecular_function	pyridoxal phosphate binding
D	0032991	cellular_component	protein-containing complex
D	0033847	molecular_function	O-phosphoserine sulfhydrylase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	15
Details	binding site for residue PLP A 401

Chain	Residue
A	LYS51
A	SER265
A	ALA294
A	ASP295
A	S16402
A	HOH518
A	HOH521
A	ASN81
A	GLY182
A	LEU183
A	GLY184
A	THR185
A	THR186
A	GLY187
A	THR188

---

site_id	AC2
Number of Residues	15
Details	binding site for residue S16 A 402

Chain	Residue
A	LYS51
A	THR78
A	SER79
A	ASN81
A	THR82
A	GLN151
A	TYR152
A	GLY184
A	THR185
A	ALA208
A	GLU209
A	PRO210
A	ALA268
A	PLP401
A	HOH536

---

site_id	AC3
Number of Residues	15
Details	binding site for residue S16 B 402

Chain	Residue
B	LYS51
B	THR78
B	SER79
B	ASN81
B	THR82
B	GLN151
B	TYR152
B	GLY184
B	THR185
B	ALA208
B	GLU209
B	PRO210
B	ALA268
B	PLP401
B	HOH538

---

site_id	AC4
Number of Residues	14
Details	binding site for residue S16 C 402

Chain	Residue
C	LYS51
C	THR78
C	SER79
C	ASN81
C	THR82
C	GLN151
C	TYR152
C	GLY184
C	ALA208
C	GLU209
C	PRO210
C	ALA268
C	PLP401
C	HOH536

---

site_id	AC5
Number of Residues	17
Details	binding site for residue S16 D 402

Chain	Residue
D	LYS51
D	THR78
D	SER79
D	ASN81
D	THR82
D	GLN151
D	TYR152
D	GLY182
D	GLY184
D	ALA208
D	GLU209
D	ASN221
D	SER265
D	ALA268
D	ALA323
D	PLP401
D	HOH526

---

site_id	AC6
Number of Residues	22
Details	binding site for Di-peptide PLP B 401 and LYS B 51

Chain	Residue
B	SER49
B	ILE50
B	ASP52
B	ARG53
B	PRO54
B	ALA55
B	ASN81
B	THR82
B	SER85
B	GLY182
B	GLY184
B	THR185
B	THR186
B	GLY187
B	THR188
B	SER265
B	ALA294
B	ASP295
B	S16402
B	HOH520
B	HOH523
B	HOH539

---

site_id	AC7
Number of Residues	22
Details	binding site for Di-peptide PLP C 401 and LYS C 51

Chain	Residue
C	ILE50
C	ASP52
C	ARG53
C	PRO54
C	ALA55
C	ASN81
C	THR82
C	SER85
C	GLY182
C	LEU183
C	GLY184
C	THR185
C	THR186
C	THR188
C	SER265
C	ALA294
C	ASP295
C	S16402
C	HOH510
C	HOH521
C	HOH531
C	SER49

---

site_id	AC8
Number of Residues	23
Details	binding site for Di-peptide PLP D 401 and LYS D 51

Chain	Residue
D	SER49
D	ILE50
D	ASP52
D	ARG53
D	PRO54
D	ALA55
D	ASN81
D	THR82
D	SER85
D	GLY182
D	GLY184
D	THR185
D	THR186
D	GLY187
D	THR188
D	SER265
D	ALA294
D	ASP295
D	ALA323
D	S16402
D	HOH504
D	HOH534
D	HOH537

---

Functional Information from PROSITE/UniProt

site_id	PS00901
Number of Residues	19
Details	CYS_SYNTHASE Cysteine synthase/cystathionine beta-synthase P-phosphate attachment site. KlEdrn.PTgSIKdRpAvrM

Chain	Residue	Details
A	LYS40-MET58

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PubMed","id":"18771296","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18799456","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19101553","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	16
Details	Binding site: {}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	4
Details	Modified residue: {"description":"N6-(pyridoxal phosphate)lysine"}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	1
Details	Binding site: {"evidences":[{"evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---