9LD3

The complex structure of K63A/2',3',5'-P-A/ADPR

This is a non-PDB format compatible entry.

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)	Probable RNA 2'-phosphotransferase	polymer	180	20920.2	2	UniProt (Q5JFX3) Pfam (PF01885)	Thermococcus kodakarensis (Pyrococcus kodakaraensis (strain KOD1))
2	C, F (A, B)	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
3	D, H (A, B)	[(2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHYL[HYDROXY-[[(2R,3S,4R,5S)-3,4,5-TRIHYDROXYOXOLAN-2-YL]METHOXY]PHOSPHORYL] HYDROGEN PHOSPHATE	non-polymer		559.3	2	Chemie (AR6)
4	E, G (A, B)	[(2~{R},3~{R},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-diphosphonooxy-oxolan-2-yl]methyl dihydrogen phosphate	non-polymer		507.2	2	Chemie (A1EJC)
5	I, J (A, B)	water	water		18.0	244	Chemie (HOH)

Sequence modifications

A, B: 1 - 180 (UniProt: Q5JFX3)

PDB	External Database	Details
Ala 63	Lys 63	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	41840.3
Non-Polymers*	Number of molecules	6
	Total formula weight	2317.2
All*	Total formula weight	44157.5

*Water molecules are not included.