3K2G

crystal structure of a resiniferatoxin-binding protein from rhodobacter sphaeroides

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 108
  • Norm. En. per Res.: -3.2312
• 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	-40.6874	-49.4866	-258.41	-348.584	110	13	3	10192	8	51	41
A-D	0.0	-16.7601	-111.55	-128.3101	48	3	4	4451	1	14	27
B-C	0.0	-13.8571	-108.106	-121.9631	49	2	4	4343	0	17	26
C-D	-28.7405	-56.9731	-263.259	-348.9726	108	10	3	10164	8	51	42

Interface residues

• A-B: ALA269A, ALA269B, ALA318A, ALA318B, ALA95B, ARG283A, ARG283B, ARG311A, ARG311B, ARG327A, ARG327B, ARG330A, ARG330B, ARG51A, ARG51B, ARG68A, ARG68B, ASN315A, ASN315B, ASP265A, ASP265B, ASP278A, ASP278B, ASP279A, ASP279B, ASP70A, ASP70B, CYS275A, CYS275B, GLN271A, GLN274A, GLN274B, GLN69A, GLN69B, GLN92A, GLN92B, GLU280A, GLU280B, GLU50A, GLU50B, GLU62A, GLU62B, GLU66A, GLU66B, GLU89A, GLU89B, GLY263A, GLY263B, GLY272A, GLY272B, GLY313A, GLY313B, GLY314A, GLY314B, GLY316A, GLY316B, HIS241A, HIS241B, HIS323A, HIS323B, HIS331A, HIS331B, ILE59A, ILE59B, ILE61A, ILE61B, ILE63A, ILE63B, LEU309A, LEU309B, LEU54A, LEU54B, LEU64A, LEU64B, LEU67A, LEU67B, LEU85A, LEU85B, LYS306A, LYS322A, LYS322B, PHE266A, PHE266B, PHE267A, PHE267B, PHE319A, PHE319B, PHE324A, PRO276A, PRO276B, PRO326A, PRO326B, SER277A, SER277B, SER60A, SER60B, SER65A, SER65B, THR310A, THR310B, TYR268A, TYR268B, TYR312A, TYR312B, TYR53A, TYR53B, VAL273A, VAL273B, VAL96A, VAL96B
• A-D: ALA248A, ALA248D, ALA251A, ALA251D, ARG213A, ARG213D, ARG253A, ARG253D, ASP220A, ASP220D, ASP243A, ASP243D, ASP290A, ASP290D, GLN247A, GLN247D, GLN252A, GLN252D, GLU223A, GLU223D, GLY254A, GLY254D, GLY287A, GLY287D, GLY292A, HIS216A, HIS216D, HIS291A, HIS291D, HIS357A, LEU219A, LEU219D, LEU229A, LEU229D, LEU250A, LEU250D, LEU288A, LEU288D, PRO244A, PRO244D, THR249A, THR249D, TYR246A, TYR246D, TYR293A, TYR293D, VAL245A, VAL245D
• B-C: ALA248B, ALA248C, ALA251B, ALA251C, ARG213B, ARG213C, ARG253B, ARG253C, ASP220B, ASP220C, ASP243B, ASP243C, ASP290B, ASP290C, GLN247B, GLN247C, GLN252B, GLN252C, GLU223B, GLU223C, GLY254B, GLY254C, GLY287B, GLY287C, GLY292B, GLY292C, HIS216B, HIS216C, HIS291B, HIS291C, HIS357B, LEU219B, LEU219C, LEU229B, LEU229C, LEU250B, LEU250C, LEU288B, LEU288C, PRO244B, PRO244C, THR249B, THR249C, TYR246B, TYR246C, TYR293B, TYR293C, VAL245B, VAL245C
• C-D: ALA269C, ALA269D, ALA318C, ALA318D, ALA95D, ARG283C, ARG283D, ARG311C, ARG311D, ARG327C, ARG327D, ARG330C, ARG330D, ARG51C, ARG51D, ARG68C, ARG68D, ASN315C, ASN315D, ASP265C, ASP265D, ASP278C, ASP278D, ASP279C, ASP279D, ASP70C, ASP70D, CYS275C, CYS275D, GLN271C, GLN274C, GLN274D, GLN69C, GLN69D, GLN92C, GLN92D, GLU280C, GLU280D, GLU50C, GLU62C, GLU62D, GLU66C, GLU66D, GLU89C, GLU89D, GLY263C, GLY263D, GLY272C, GLY272D, GLY313C, GLY313D, GLY314C, GLY314D, GLY316C, GLY316D, HIS241C, HIS241D, HIS323C, HIS323D, HIS331C, HIS331D, ILE59C, ILE59D, ILE61C, ILE61D, ILE63C, ILE63D, LEU309C, LEU309D, LEU54C, LEU54D, LEU64C, LEU64D, LEU67C, LEU67D, LEU85C, LYS306C, LYS322C, LYS322D, PHE266C, PHE266D, PHE267C, PHE267D, PHE319C, PHE319D, PHE324C, PHE324D, PRO276C, PRO276D, PRO326C, PRO326D, SER277C, SER277D, SER60C, SER60D, SER65C, SER65D, THR310C, THR310D, TYR268C, TYR268D, TYR312C, TYR312D, TYR53C, TYR53D, VAL273C, VAL273D, VAL96D