9DM9

HIV-RT pre-catalytic complex with MK-8527

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 (A)	Reverse transcriptase/ribonuclease H	polymer	562	64752.2	1	UniProt (P04585) Pfam (PF00078) Pfam (PF06817) Pfam (PF06815) Pfam (PF00075)	HIV-1 M:B_HXB2R	Exoribonuclease H,p66 RT
2	B (B)	p51 RT	polymer	455	53201.0	1	UniProt (P04585) Pfam (PF00078) Pfam (PF06817) Pfam (PF06815)	HIV-1 M:B_HXB2R
3	C (P)	DNA Primer	polymer	21	6490.3	1		synthetic construct
4	D (T)	DNA Template	polymer	27	8383.4	1		synthetic construct
5	E, G (A)	MAGNESIUM ION	non-polymer		24.3	2	Chemie (MG)
6	F (A)	2-chloro-7-{(4xi)-2-deoxy-4-ethynyl-5-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-erythro-pentofuranosyl}-7H-pyrrolo[2,3-d]pyrimidin-4-amine	non-polymer		548.7	1	Chemie (A1A6R)

Sequence modifications

A: 1 - 560 (UniProt: P04585)

PDB	External Database	Details
Met -1	-	expression tag
Val 0	-	expression tag
Cys 258	Gln 845	engineered mutation
Ser 280	Cys 867	engineered mutation

B: 1 - 440 (UniProt: P04585)

PDB	External Database	Details
Met -14	-	expression tag
Ala -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
Leu -6	-	expression tag
Glu -5	-	expression tag
Val -4	-	expression tag
Leu -3	-	expression tag
Phe -2	-	expression tag
Gln -1	-	expression tag
Gly 0	-	expression tag
Ser 280	Cys 867	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	132826.9
Non-Polymers*	Number of molecules	3
	Total formula weight	597.3
All*	Total formula weight	133424.2

*Water molecules are not included.