5KGN

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

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	2,3-bisphosphoglycerate-independent phosphoglycerate mutase	polymer	534	58704.5	2	UniProt (G5EFZ1) Pfam (PF01676) Pfam (PF06415)	Caenorhabditis elegans	iPGM,Cofactor-independent phosphoglycerate mutase homolog
2	C, D (C, D)	macrocyclic peptide inhibitor	polymer	13	1458.6	2		synthetic construct
3	E, J (A, B)	CHLORIDE ION	non-polymer		35.5	2	Chemie (CL)
4	F, K (A, B)	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
5	G, L (A, B)	MAGNESIUM ION	non-polymer		24.3	2	Chemie (MG)
6	H, M (A, B)	MANGANESE (II) ION	non-polymer		54.9	2	Chemie (MN)
7	I, N (A, B)	ZINC ION	non-polymer		65.4	2	Chemie (ZN)
8	O, P, Q, R (A, B, C, D)	water	water		18.0	735	Chemie (HOH)

Sequence modifications

A, B: 19 - 539 (UniProt: G5EFZ1)

PDB	External Database	Details
Lys 540	-	expression tag
Leu 541	-	expression tag
Ala 542	-	expression tag
Ala 543	-	expression tag
Ala 544	-	expression tag
Leu 545	-	expression tag
Glu 546	-	expression tag
His 547	-	expression tag
His 548	-	expression tag
His 549	-	expression tag
His 550	-	expression tag
His 551	-	expression tag
His 552	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	120326.2
Non-Polymers*	Number of molecules	10
	Total formula weight	544.4
All*	Total formula weight	120870.6

*Water molecules are not included.