5KGN

1.95A resolution structure of independent phosphoglycerate mutase from C. elegans in complex with a macrocyclic peptide inhibitor (2d)

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0003824	molecular_function	catalytic activity
A	0004619	molecular_function	phosphoglycerate mutase activity
A	0005737	cellular_component	cytoplasm
A	0005975	biological_process	carbohydrate metabolic process
A	0006007	biological_process	glucose catabolic process
A	0006096	biological_process	glycolytic process
A	0016853	molecular_function	isomerase activity
A	0030145	molecular_function	manganese ion binding
A	0046872	molecular_function	metal ion binding
B	0003824	molecular_function	catalytic activity
B	0004619	molecular_function	phosphoglycerate mutase activity
B	0005737	cellular_component	cytoplasm
B	0005975	biological_process	carbohydrate metabolic process
B	0006007	biological_process	glucose catabolic process
B	0006096	biological_process	glycolytic process
B	0016853	molecular_function	isomerase activity
B	0030145	molecular_function	manganese ion binding
B	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	3
Details	binding site for residue CL A 601

Chain	Residue
A	ARG97
A	ASN336
A	HOH869

---

site_id	AC2
Number of Residues	7
Details	binding site for residue GOL A 602

Chain	Residue
A	ARG287
A	HIS147
A	ARG177
A	ASP178
A	ARG210
A	ARG216
A	ARG284

---

site_id	AC3
Number of Residues	6
Details	binding site for residue MG A 603

Chain	Residue
A	ILE50
A	LEU51
A	ALA53
A	THR55
A	HOH808
A	HOH944

---

site_id	AC4
Number of Residues	6
Details	binding site for residue MN A 604

Chain	Residue
A	ASP426
A	HIS430
A	HIS485
A	HOH770
A	HOH998
A	HOH1000

---

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

Chain	Residue
A	ASP37
A	SER86
A	ASP467
A	HIS468

---

site_id	AC6
Number of Residues	2
Details	binding site for residue CL B 601

Chain	Residue
B	ARG97
B	ASN336

---

site_id	AC7
Number of Residues	7
Details	binding site for residue GOL B 602

Chain	Residue
B	HIS147
B	ARG177
B	ASP178
B	ARG210
B	ARG216
B	ARG284
B	ARG287

---

site_id	AC8
Number of Residues	6
Details	binding site for residue MG B 603

Chain	Residue
B	ILE50
B	LEU51
B	ALA53
B	THR55
B	HOH735
B	HOH807

---

site_id	AC9
Number of Residues	6
Details	binding site for residue MN B 604

Chain	Residue
B	ASP426
B	HIS430
B	HIS485
B	HOH711
B	HOH933
B	HOH952

---

site_id	AD1
Number of Residues	4
Details	binding site for residue ZN B 605

Chain	Residue
B	ASP37
B	SER86
B	ASP467
B	HIS468

---

site_id	AD2
Number of Residues	13
Details	binding site for Di-peptide ACE C 0 and DTY C 1

Chain	Residue
A	GLU87
A	PHE365
A	PHE366
C	ASP2
C	TYR3
C	ASP6
C	TYR7
C	CYS8
C	TYR9
C	TYR11
C	NH212
C	HOH104
C	HOH107

---

site_id	AD3
Number of Residues	8
Details	binding site for Di-peptide ACE C 0 and CYS C 8

Chain	Residue
C	DTY1
C	ASP2
C	ASP6
C	TYR7
C	TYR9
C	LEU10
C	TYR11
C	NH212

---

site_id	AD4
Number of Residues	15
Details	binding site for Di-peptide DTY C 1 and ASP C 2

Chain	Residue
A	GLU87
A	ARG289
A	PHE365
A	PHE366
C	ACE0
C	TYR3
C	ASP6
C	CYS8
C	TYR9
C	TYR11
C	NH212
C	HOH101
C	HOH104
C	HOH106
C	HOH107

---

site_id	AD5
Number of Residues	6
Details	binding site for Di-peptide TYR C 11 and NH2 C 12

Chain	Residue
A	ASN85
A	GLU87
C	DTY1
C	CYS8
C	TYR9
C	LEU10

---

site_id	AD6
Number of Residues	8
Details	binding site for Di-peptide ACE D 0 and CYS D 8

Chain	Residue
D	TYR11
D	NH212
D	DTY1
D	ASP2
D	ASP6
D	TYR7
D	TYR9
D	LEU10

---

site_id	AD7
Number of Residues	12
Details	binding site for Di-peptide ACE D 0 and DTY D 1

Chain	Residue
B	GLU87
B	PHE365
B	PHE366
D	ASP2
D	TYR3
D	ASP6
D	TYR7
D	CYS8
D	TYR9
D	NH212
D	HOH103
D	HOH105

---

site_id	AD8
Number of Residues	14
Details	binding site for Di-peptide DTY D 1 and ASP D 2

Chain	Residue
B	GLU87
B	ARG289
B	PHE365
B	PHE366
D	ACE0
D	TYR3
D	ASP6
D	CYS8
D	TYR9
D	NH212
D	HOH101
D	HOH103
D	HOH105
D	HOH106

---

site_id	AD9
Number of Residues	7
Details	binding site for Di-peptide TYR D 11 and NH2 D 12

Chain	Residue
B	ASN85
B	GLU87
B	HOH727
D	DTY1
D	CYS8
D	TYR9
D	LEU10

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Active site: {"evidences":[{"source":"UniProtKB","id":"Q9X519","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	30
Details	Binding site: {"evidences":[{"source":"UniProtKB","id":"Q9X519","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

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