3RQ1

crystal structure of aminotransferase class i and ii from veillonella parvula

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 285
  • Norm. En. per Res.: -4.3082
• 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	-2.4038	-2.4432	-43.3448	-48.1918	52	4	0	2381	0	33	33
A-C	-179.4756	-125.0078	-923.351	-1227.8344	285	49	33	37189	6	78	94
B-D	-179.7724	-133.2228	-876.478	-1189.4733	283	59	33	36632	7	77	89

Interface residues

• A-B: ALA211B, ALA335A, ALA343A, ARG214B, ARG332A, ARG334A, ARG353A, ASN166B, ASN169B, ASN204B, ASN240B, ASN325A, ASP200B, ASP208B, ASP276B, ASP333A, ASP336A, GLN165B, GLN329A, GLN340A, GLN344A, GLU155B, GLU162B, GLU195A, GLU231A, GLU234A, GLU341A, GLU48A, HIS161B, HIS244B, ILE212B, ILE249B, ILE337A, LEU203B, LEU245B, LEU330A, LYS197A, LYS197B, LYS207B, LYS232A, LYS241B, LYS247B, LYS318A, LYS339A, LYS395A, PHE205B, PHE242B, PHE338A, PRO246B, SER201B, SER243B, TYR352A
• A-C: ALA106A, ALA106C, ALA135A, ALA135C, ALA224C, ALA22A, ALA281A, ALA281C, ALA294A, ALA294C, ALA303A, ALA303C, ALA44A, ALA44C, ALA5A, ALA5C, ALA6A, ALA6C, ALA74A, ALA74C, ALA77A, ALA77C, ALA9A, ALA9C, ARG101A, ARG137A, ARG137C, ARG145A, ARG145C, ARG267A, ARG267C, ARG293A, ARG293C, ARG301A, ARG301C, ARG34A, ARG387A, ARG387C, ASN118A, ASN118C, ASN177A, ASN177C, ASN188A, ASN188C, ASN215A, ASN215C, ASN216A, ASN216C, ASN288A, ASN288C, ASN298A, ASN298C, ASN51A, ASN51C, ASP124A, ASP124C, ASP142A, ASP142C, ASP16A, ASP16C, ASP277A, ASP277C, ASP282A, ASP282C, ASP67A, ASP67C, CYS140A, CYS140C, CYS300A, CYS300C, CYS391A, GLN266A, GLN266C, GLN26A, GLN26C, GLU121A, GLU121C, GLU248A, GLU248C, GLU278A, GLU278C, GLU279A, GLU279C, GLU283A, GLU283C, GLU286A, GLU286C, GLU69A, GLU69C, GLY107A, GLY107C, GLY108A, GLY108C, GLY110A, GLY110C, GLY111A, GLY111C, GLY11A, GLY11C, GLY134A, GLY134C, GLY144A, GLY144C, GLY23A, GLY265A, GLY265C, GLY43A, GLY43C, GLY72A, GLY72C, HIS113A, HIS113C, HIS114A, HIS114C, HIS117A, HIS117C, HIS46A, HIS46C, HIS70A, HIS70C, HIS8A, HIS8C, ILE103C, ILE112A, ILE112C, ILE116A, ILE116C, ILE139A, ILE139C, ILE18A, ILE18C, ILE218A, ILE218C, ILE219C, ILE249A, ILE249C, ILE280A, ILE280C, ILE299A, ILE299C, ILE45A, ILE45C, ILE76A, ILE76C, LEU115A, LEU115C, LEU14A, LEU14C, LEU250A, LEU250C, LEU257C, LEU42A, LEU42C, LEU52A, LEU52C, LEU55A, LEU55C, LEU63A, LEU63C, LEU65A, LEU65C, LYS10A, LYS10C, LYS12A, LYS12C, LYS13A, LYS13C, LYS15A, LYS15C, LYS247A, LYS247C, LYS259A, LYS259C, LYS289A, LYS289C, LYS56A, LYS56C, LYS59A, LYS59C, LYS7A, LYS7C, PHE19A, PHE19C, PHE261A, PHE261C, PHE284A, PHE284C, PHE285A, PHE285C, PHE356A, PHE356C, PHE357A, PHE357C, PHE54A, PHE54C, PRO122A, PRO122C, PRO246A, PRO246C, PRO302A, PRO302C, PRO75A, PRO75C, SER141A, SER141C, SER256C, SER258A, SER258C, SER275A, SER275C, SER290A, SER290C, SER292A, SER292C, SER297A, SER297C, SER3A, SER3C, SER64A, SER64C, SER66A, SER66C, SER68A, SER68C, THR105A, THR105C, THR109A, THR109C, THR120A, THR120C, THR143A, THR143C, THR176A, THR176C, THR251A, THR251C, THR262A, THR262C, THR291A, THR291C, THR295A, THR295C, THR2A, THR2C, THR306C, TRP133A, TRP133C, TRP296A, TRP296C, TYR119A, TYR119C, TYR136A, TYR136C, TYR225A, TYR225C, TYR264A, TYR264C, TYR62A, TYR62C, TYR73A, TYR73C, VAL138A, VAL138C, VAL178A, VAL178C, VAL179A, VAL179C, VAL17A, VAL17C, VAL20A, VAL20C, VAL217A, VAL217C, VAL268A, VAL268C, VAL287A, VAL287C, VAL4A, VAL4C, VAL53A, VAL53C, VAL58A, VAL58C, VAL71A, VAL71C
• B-D: ALA106B, ALA106D, ALA135B, ALA135D, ALA224D, ALA22B, ALA22D, ALA281B, ALA281D, ALA294B, ALA294D, ALA303B, ALA303D, ALA44B, ALA44D, ALA5B, ALA5D, ALA6B, ALA6D, ALA74B, ALA74D, ALA77B, ALA77D, ALA9B, ALA9D, ARG101B, ARG137B, ARG137D, ARG145B, ARG145D, ARG267B, ARG267D, ARG293B, ARG293D, ARG301B, ARG301D, ARG387B, ARG387D, ASN118B, ASN118D, ASN177B, ASN177D, ASN188B, ASN188D, ASN215B, ASN215D, ASN216B, ASN216D, ASN288B, ASN288D, ASN298B, ASN298D, ASN51B, ASN51D, ASP124B, ASP124D, ASP142B, ASP142D, ASP16B, ASP16D, ASP277B, ASP277D, ASP282B, ASP282D, ASP67B, ASP67D, CYS140B, CYS140D, CYS300B, CYS300D, CYS391B, GLN266B, GLN266D, GLN26B, GLN26D, GLU121B, GLU121D, GLU248B, GLU248D, GLU278B, GLU278D, GLU279B, GLU279D, GLU283B, GLU283D, GLU286B, GLU286D, GLU69B, GLU69D, GLY107B, GLY107D, GLY108B, GLY108D, GLY110B, GLY110D, GLY111B, GLY111D, GLY11B, GLY11D, GLY134B, GLY134D, GLY144B, GLY144D, GLY23B, GLY23D, GLY265B, GLY265D, GLY43B, GLY43D, GLY72B, GLY72D, HIS113B, HIS113D, HIS114B, HIS114D, HIS117B, HIS117D, HIS46B, HIS46D, HIS70B, HIS70D, HIS8B, HIS8D, ILE112B, ILE112D, ILE116B, ILE116D, ILE139B, ILE139D, ILE18B, ILE18D, ILE218B, ILE218D, ILE219B, ILE249B, ILE249D, ILE280B, ILE280D, ILE299B, ILE299D, ILE45B, ILE45D, ILE76B, ILE76D, ILE79B, LEU115B, LEU115D, LEU14B, LEU14D, LEU250B, LEU250D, LEU257B, LEU42B, LEU42D, LEU52B, LEU52D, LEU55B, LEU55D, LEU63B, LEU63D, LEU65B, LEU65D, LYS10B, LYS10D, LYS12B, LYS12D, LYS13B, LYS13D, LYS15B, LYS15D, LYS247B, LYS247D, LYS259B, LYS259D, LYS289B, LYS289D, LYS56B, LYS56D, LYS59B, LYS59D, LYS7B, LYS7D, PHE19B, PHE19D, PHE261B, PHE261D, PHE284B, PHE284D, PHE285B, PHE285D, PHE356B, PHE356D, PHE357B, PHE357D, PHE54B, PHE54D, PRO122B, PRO122D, PRO246D, PRO302B, PRO302D, PRO75B, PRO75D, SER141B, SER141D, SER256D, SER258B, SER258D, SER275B, SER275D, SER290B, SER290D, SER292B, SER292D, SER297B, SER297D, SER3B, SER3D, SER64B, SER64D, SER66B, SER66D, SER68B, SER68D, THR105B, THR105D, THR109B, THR109D, THR120B, THR120D, THR143B, THR143D, THR176B, THR176D, THR251D, THR262B, THR262D, THR291B, THR291D, THR295B, THR295D, THR2B, THR2D, THR306B, TRP133B, TRP133D, TRP296B, TRP296D, TYR119B, TYR119D, TYR136B, TYR136D, TYR225B, TYR225D, TYR264B, TYR264D, TYR62B, TYR62D, TYR73B, TYR73D, VAL138B, VAL138D, VAL178B, VAL179B, VAL179D, VAL17B, VAL17D, VAL20B, VAL20D, VAL217B, VAL217D, VAL268B, VAL268D, VAL287B, VAL287D, VAL4B, VAL4D, VAL53B, VAL53D, VAL58B, VAL58D, VAL71B, VAL71D