3IB8

Crystal structure of full length Rv0805 in complex with 5'-AMP

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Icc protein	polymer	330	35526.4	1	UniProt (O06629) Pfam (PF00149) UniProt (by SIFTS) (P9WP65) In PDB	Mycobacterium tuberculosis	Rv0805 phosphodiesterase protein
2	A	FE (III) ION	non-polymer		55.8	1	Chemie (FE)
3	A	MANGANESE (II) ION	non-polymer		54.9	1	Chemie (MN)
4	A	ADENOSINE MONOPHOSPHATE	non-polymer		347.2	1	Chemie (AMP)
5	A	2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		209.2	1	Chemie (BTB)
6	A	(4S)-2-METHYL-2,4-PENTANEDIOL	non-polymer		118.2	3	Chemie (MPD)
7	A	ACETATE ION	non-polymer		59.0	1	Chemie (ACT)
8		water	water		18.0	247	Chemie (HOH)

Sequence modifications

A: 2 - 318 (UniProt: O06629)

PDB	External Database	Details
Gly -11	-	expression tag
Ala -10	-	expression tag
Met -9	-	expression tag
Gly -8	-	expression tag
Ile -7	-	expression tag
Arg -6	-	expression tag
Asn -5	-	expression tag
Ser -4	-	expression tag
Lys -3	-	expression tag
Ala -2	-	expression tag
Tyr -1	-	expression tag
Val 0	-	expression tag
Glu 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	35526.4
Non-Polymers*	Number of molecules	8
	Total formula weight	1080.8
All*	Total formula weight	36607.2

*Water molecules are not included.