1J7Y

Crystal structure of partially ligated mutant of HbA

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, C	Hemoglobin	polymer	141	15222.4	2	UniProt (P69905) Pfam (PF00042) In PDB	Homo sapiens (human)
2	B, D	Hemoglobin	polymer	146	15962.3	2	UniProt (P68871) Pfam (PF00042) In PDB	Homo sapiens (human)
3	A, B, C, D	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	4	Chemie (HEM)
4	B	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
5	B, D	CARBON MONOXIDE	non-polymer		28.0	2	Chemie (CMO)
6		water	water		18.0	440	Chemie (HOH)

Sequence modifications

A, C: 1 - 141 (UniProt: P69905)

PDB	External Database	Details
Met 1	Val 1	engineered mutation
Tyr 29	Leu 29	engineered mutation
Gln 58	His 58	engineered mutation

B, D: 1 - 146 (UniProt: P68871)

PDB	External Database	Details
Met 1	Val 1	engineered mutation
Tyr 28	Leu 28	engineered mutation
Gln 63	His 63	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	62369.4
Non-Polymers*	Number of molecules	8
	Total formula weight	2714.1
All*	Total formula weight	65083.5

*Water molecules are not included.