7XJ5

Crystal structure of engineered HIV-1 Reverse Transcriptase RNase H domain complexed with nitrofuran methoxy(methoxycarbonyl)phenyl ester

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 RNase H domain	polymer	151	16832.3	1	UniProt (A0A059PIR4) UniProt (A0A7L9QW77) Pfam (PF00075) UniProt (by SIFTS) (P04585)	Human immunodeficiency virus 1
2	B (A)	[2-[tert-butyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-5-nitro-furan-2-carboxylate	non-polymer		439.3	1	Chemie (ECW)
3	C, D (A)	MANGANESE (II) ION	non-polymer		54.9	2	Chemie (MN)
4	E, F (A)	ZINC ION	non-polymer		65.4	2	Chemie (ZN)
5	G (A)	water	water		18.0	34	Chemie (HOH)

Sequence modifications

A: 7 - 80 (UniProt: A0A059PIR4)

PDB	External Database	Details
Gly 1	-	expression tag
Pro 2	-	expression tag
Gly 3	-	expression tag
Gly 4	-	expression tag
Ser 5	-	expression tag
Met 6	-	expression tag
Tyr 81	-	linker
Ala 82	-	linker
Leu 83	-	linker
Gly 84	-	linker
Ile 85	-	linker
Ile 86	-	linker
Thr 87	-	linker
Gln 88	-	linker
Trp 89	-	linker
Ile 90	-	linker
His 91	-	linker
Asn 92	-	linker
Trp 93	-	linker
Lys 94	-	linker
Lys 95	-	linker
Arg 96	-	linker
Gly 97	-	linker
Trp 98	-	linker
Lys 99	-	linker
Thr 100	-	linker
Pro 101	-	linker
Val 102	-	linker
Lys 103	-	linker
Asn 104	-	linker
Val 105	-	linker

A: 106 - 151 (UniProt: A0A7L9QW77)

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	16832.3
Non-Polymers*	Number of molecules	5
	Total formula weight	680.0
All*	Total formula weight	17512.2

*Water molecules are not included.