3KZS

crystal structure of glycosyl hydrolase family 5 (np_809925.1) from bacteroides thetaiotaomicron vpi-5482 at 2.10 a resolution

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 90
  • Norm. En. per Res.: -2.6042
• Hub Node: A(2)

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	-7.1076	-24.8865	-202.385	-234.3791	90	4	2	7596	4	34	40
A-D	0.0	0.0	-0.0218	-0.0218	2	0	0	7	0	2	2
B-C	-6.7468	-41.0622	-120.473	-168.282	67	1	2	4236	3	14	11
C-D	0.0	0.0	-0.8939	-0.8939	19	0	0	198	0	11	6

Interface residues

• A-B: ARG244A, ARG244B, ARG248A, ARG248B, ARG309A, ARG309B, ARG388A, ARG388B, ARG391A, ARG391B, ARG409A, ARG409B, ASN259A, ASN259B, ASN385A, ASN385B, ASN405A, ASN405B, ASN458A, ASN458B, ASP306A, ASP306B, ASP390A, ASP390B, ASP451A, ASP451B, GLN247A, GLN247B, GLN384A, GLN384B, GLN449A, GLN449B, GLU258A, GLU258B, GLU261A, GLU261B, GLU262A, GLU262B, GLU299A, GLU299B, GLU387A, GLU387B, GLY246A, GLY246B, GLY386A, GLY386B, GLY408A, GLY408B, GLY453A, GLY453B, GLY457A, GLY457B, HIS292A, HIS292B, HIS450A, HIS450B, LEU300A, LEU300B, LYS431A, LYS431B, LYS447A, LYS447B, PHE249A, PHE249B, PHE448A, PHE448B, PRO410A, PRO410B, SER452A, SER452B, SER455A, SER455B, SER456A, SER456B, THR407A, THR407B, TRP302A, TRP302B, TRP313A, TRP313B, TYR245A, TYR245B, TYR305A, TYR305B, TYR389A, TYR389B, TYR406A, TYR406B, TYR454A, TYR454B
• A-D: ASP251D, GLU440A
• B-C: ALA343B, ALA74C, ARG68B, ARG71C, ARG83C, ASN101B, ASN101C, ASN113B, ASN70C, ASN95B, ASN96B, ASP110B, ASP127C, ASP349C, ASP72C, GLN105B, GLN105C, GLN119B, GLN119C, GLN331B, GLN80C, GLU297B, GLU67B, GLU73C, GLU75C, GLU79C, GLY104B, GLY104C, GLY111B, GLY121C, GLY124C, GLY336B, GLY338B, GLY339B, HIS128C, ILE102B, ILE102C, ILE117B, ILE333B, LEU351C, LEU64B, LEU69C, LYS120C, LYS334B, LYS334C, LYS344B, PHE332B, PRO335B, PRO335C, PRO346B, PRO346C, PRO98B, SER99B, THR109B, TRP347C, TYR103B, TYR103C, TYR106B, TYR123C, TYR131C, TYR348B, TYR348C, TYR76C, TYR77C, VAL122B, VAL122C, VAL337B
• C-D: ALA195D, ALA230D, ARG134C, ASN229D, ASN35C, ASN51C, ASP161D, ASP176C, ASP191D, GLU198D, ILE31C, LYS164D, LYS193D, LYS28C, PRO178C, PRO231D, SER34C, THR194D, THR29C