3T7S

crystal structure of complex of sam and bvu_3255, a methyltransferase from bacteroides vulgatus atcc 8482

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 110
  • Norm. En. per Res.: -2.8535
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-56.4087	0.4985	-211.047	-266.9572	102	13	15	9165	0	13	10
A-C	0.0	6.4189	-18.1797	-11.7608	18	0	0	865	0	8	10
A-D	0.0	0.5096	-14.7592	-14.2496	27	0	0	1193	0	12	17
B-C	0.0	19.3488	-29.6701	-10.3213	33	9	0	1801	0	12	9
C-D	-66.2823	-0.4495	-247.154	-313.8858	110	12	15	10403	0	10	13

Interface residues

• A-B: ALA181A, ALA181B, ALA192A, ALA192B, ALA245A, ALA245B, ALA250A, ALA250B, ALA37A, ALA37B, ARG158A, ARG158B, ASN178A, ASN178B, ASN199A, ASN199B, ASP156A, ASP156B, ASP42A, ASP42B, GLN157A, GLN157B, GLN182A, GLN182B, GLN184A, GLN184B, GLU198A, GLU198B, GLY187A, GLY187B, GLY257A, GLY257B, ILE183A, ILE183B, ILE189A, ILE189B, ILE195A, ILE195B, ILE253A, ILE253B, ILE41A, ILE41B, LEU196A, LEU196B, LEU35A, LEU35B, LEU38A, LEU38B, LYS179A, LYS179B, LYS185A, LYS185B, LYS255A, LYS255B, LYS36A, LYS36B, PHE154A, PHE154B, PHE194A, PHE194B, PHE251A, PHE251B, PHE252A, PHE252B, PHE258A, PHE258B, PHE40A, PHE40B, PRO177A, PRO177B, PRO190A, PRO190B, PRO197A, PRO197B, SER259A, SER39A, SER39B, THR155A, THR155B, THR175A, THR175B, THR193A, THR193B, TRP153A, TRP153B, TYR145A, TYR145B, TYR188A, TYR188B, TYR246A, TYR246B, TYR247A, VAL152A, VAL152B, VAL176A, VAL176B, VAL180A, VAL180B, VAL191A, VAL191B, VAL33A, VAL33B
• A-C: ALA160C, ARG158C, ASP156C, GLN157C, GLN66A, GLU32A, HIS204A, HIS67A, ILE63A, LEU35A, LYS36A, PRO159C, PRO31A, SER30A, SER39A, THR155C, TYR246C, VAL33A
• A-D: ARG137D, ARG84A, ASN138D, ASN88A, ASN93A, ASP113D, GLN66A, GLU135D, GLU24A, GLU90A, GLY187D, GLY257D, HIS67A, LEU140D, LEU92A, LYS112D, LYS134D, LYS141D, LYS185D, LYS211A, LYS256D, LYS87A, LYS91A, PHE258D, PRO142D, PRO208A, SER259D
• B-C: ALA160C, ALA169C, ALA65B, ARG224C, ARG84B, ASN88B, ASP164C, GLN66B, GLU161C, GLU228C, GLU32B, HIS163C, HIS235C, HIS67B, ILE225C, ILE63B, LEU35B, LEU38B, LEU64B, LEU92B, LYS36B, LYS87B, LYS91B, MET167C, MET62B, PHE165C, PRO31B, PRO69B, SER168C, SER39B, THR171C, TRP166C, VAL68B
• C-D: ALA181C, ALA181D, ALA192C, ALA192D, ALA245C, ALA245D, ALA250C, ALA250D, ALA37C, ALA37D, ARG158C, ARG261D, ASN178C, ASN178D, ASN199C, ASN199D, ASP156C, ASP156D, ASP42C, ASP42D, CYS254C, GLN157C, GLN157D, GLN182C, GLN182D, GLN184C, GLN184D, GLU198C, GLU198D, GLY187C, GLY187D, GLY248C, GLY257C, GLY257D, ILE183C, ILE183D, ILE189C, ILE189D, ILE195C, ILE195D, ILE253C, ILE253D, ILE41C, ILE41D, LEU196C, LEU196D, LEU260D, LEU35C, LEU35D, LEU38C, LEU38D, LYS179C, LYS179D, LYS185C, LYS185D, LYS244C, LYS255C, LYS255D, LYS36C, LYS36D, PHE154C, PHE154D, PHE194C, PHE194D, PHE251C, PHE251D, PHE252C, PHE252D, PHE258C, PHE258D, PHE40C, PHE40D, PRO159C, PRO177C, PRO177D, PRO190C, PRO190D, PRO197C, PRO197D, SER259D, SER39C, SER39D, THR155C, THR155D, THR175C, THR175D, THR193C, THR193D, TRP153C, TRP153D, TYR145C, TYR188C, TYR188D, TYR240C, TYR243C, TYR246C, TYR246D, TYR247C, TYR247D, TYR249C, VAL152C, VAL152D, VAL176C, VAL176D, VAL180C, VAL180D, VAL191C, VAL191D, VAL33C, VAL33D