3GI8

crystal structure of apct k158a transporter bound to 7f11 monoclonal fab fragment

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-H
  • Int. Res.: 74
  • Norm. En. per Res.: -3.0838
• Hub Node: C(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
C-L	0.0	0.0	-24.4976	-24.4976	17	0	0	983	0	1	1
C-H	-23.5177	-10.6714	-194.009	-228.1981	74	5	6	8012	2	21	16
L-H	-14.4633	-8.0413	220.921	198.4165	193	17	8	19463	1	14	11

Interface residues

• C-L: ALA40L, ARG149C, ARG60L, ASN34L, GLU2C, GLU61L, HIS97L, LEU3C, LEU52L, LYS145C, LYS4C, LYS6C, MET1C, PHE56L, SER62L, THR59L, TYR55L
• C-H: ARG314C, ARG425C, ARG98H, ASN108H, ASN297C, ASN429C, ASN430C, ASN5C, ASP112H, ASP305C, ASP52H, ASP55H, GLN1H, GLU2C, GLU307C, GLU310C, GLU313C, GLY104H, GLY26H, GLY306C, HIS101H, HIS213C, LEU308C, LEU3C, LYS145C, LYS304C, LYS315C, LYS319C, LYS424C, LYS434C, LYS4C, LYS6C, LYS74H, MET111H, MET1C, MET431C, PHE29H, PHE311C, PHE312C, PHE318C, PHE427C, PRO100H, PRO110H, PRO309C, PRO53H, SER301C, SER31H, SER320C, SER428C, SER435C, SER54H, SER56H, SER75H, SER77H, SER99H, THR105H, THR106H, THR28H, THR30H, THR423C, THR426C, TRP317C, TRP33H, TYR102H, TYR103H, TYR107H, TYR109H, TYR113H, TYR27H, TYR32H, TYR57H, VAL2H, VAL316C, VAL433C
• L-H: ALA136H, ALA136L, ALA179H, ALA40L, ALA57L, ALA97H, ARG217L, ARG98H, ASN108H, ASN143L, ASN144L, ASN167L, ASN216L, ASN31L, ASN34L, ASN59H, ASN61H, ASN63H, ASP112H, ASP171L, ASP173L, ASP176L, ASP1L, ASP91L, CYS139H, CYS140L, CYS151H, CYS220L, CYS94L, CYS96H, GLN116H, GLN130L, GLN182H, GLN35L, GLN39H, GLN43H, GLN43L, GLN44L, GLN48L, GLN62H, GLN6H, GLN6L, GLN95L, GLN96L, GLU129L, GLU219L, GLU222H, GLU46H, GLU50H, GLU61L, GLY105L, GLY106L, GLY107L, GLY115H, GLY117H, GLY134L, GLY135L, GLY138H, GLY150H, GLY164L, GLY42H, GLY44H, GLY47L, GLY49H, HIS175H, HIS97L, ILE123L, ILE48H, LEU131L, LEU135H, LEU142L, LEU149H, LEU152H, LEU166L, LEU180H, LEU181H, LEU185H, LEU185L, LEU187L, LEU221H, LEU39L, LEU45H, LEU4H, LEU52L, LEU53L, LYS109L, LYS154H, LYS175L, LYS213L, LYS219H, LYS220H, LYS36L, LYS38H, LYS51L, MET111H, MET181L, MET188H, PHE104L, PHE124L, PHE141L, PHE145L, PHE177H, PHE215L, PHE56L, PHE92L, PHE93L, PHE95H, PRO100H, PRO101L, PRO110H, PRO125L, PRO126L, PRO134H, PRO137H, PRO178H, PRO223H, PRO46L, PRO50L, SER122L, SER127L, SER128L, SER131H, SER133L, SER137L, SER146H, SER168L, SER172H, SER173H, SER180L, SER182L, SER183H, SER183L, SER189H, SER190H, SER191H, SER214L, SER33L, SER49L, SER62L, SER99H, SER99L, THR100L, THR103L, THR105H, THR106H, THR120L, THR132L, THR143H, THR148H, THR170L, THR176H, THR178L, THR184L, THR186L, THR187H, THR193H, THR32L, THR59L, TRP114H, TRP165H, TRP169L, TRP199H, TRP33H, TRP36H, TRP41L, TRP47H, TYR102H, TYR102L, TYR107H, TYR109H, TYR113H, TYR133H, TYR179L, TYR186H, TYR35H, TYR38L, TYR42L, TYR55L, TYR57H, TYR60H, TYR98L, VAL121L, VAL132H, VAL138L, VAL139L, VAL147H, VAL153H, VAL165L, VAL174H, VAL192H, VAL37H, VAL54L, VAL93H