4A6N

STRUCTURE OF THE TETRACYCLINE DEGRADING MONOOXYGENASE TETX IN COMPLEX WITH TIGECYCLINE

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	TETX2 PROTEIN	polymer	398	44703.5	1	UniProt (Q93L51) Pfam (PF01494) In PDB	BACTEROIDES THETAIOTAOMICRON	TETX
2	B, C, D	TETX2 PROTEIN	polymer	398	44703.4	3	UniProt (Q93L51) Pfam (PF01494) In PDB	BACTEROIDES THETAIOTAOMICRON	TETX
3	A, B, C, D	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	4	Chemie (FAD)
4	A, B, C, D	TIGECYCLINE	non-polymer		587.7	4	Chemie (T1C)
5	A, B, C, D	SULFATE ION	non-polymer		96.1	11	Chemie (SO4)
6		water	water		18.0	210	Chemie (HOH)

Sequence modifications

A: 11 - 388 (UniProt: Q93L51)

PDB	External Database	Details
Met -9	-	expression tag
Gly -8	-	expression tag
Ser -7	-	expression tag
Ser -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Ser 1	-	expression tag
Ser 2	-	expression tag
Gly 3	-	expression tag
Leu 4	-	expression tag
Val 5	-	expression tag
Pro 6	-	expression tag
Arg 7	-	expression tag
Gly 8	-	expression tag
Ser 9	-	expression tag
His 10	-	expression tag
Lys 272	Glu 272	conflict

B, C, D: 11 - 388 (UniProt: Q93L51)

PDB	External Database	Details
Met -9	-	expression tag
Gly -8	-	expression tag
Ser -7	-	expression tag
Ser -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Ser 1	-	expression tag
Ser 2	-	expression tag
Gly 3	-	expression tag
Leu 4	-	expression tag
Val 5	-	expression tag
Pro 6	-	expression tag
Arg 7	-	expression tag
Gly 8	-	expression tag
Ser 9	-	expression tag
His 10	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	178813.6
Non-Polymers*	Number of molecules	19
	Total formula weight	6549.6
All*	Total formula weight	185363.2

*Water molecules are not included.