3L1T

e. coli nrfa sulfite ocmplex

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 138
  • Norm. En. per Res.: -3.054
• 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	-11.7214	-115.6991	-294.027	-421.4475	138	7	6	14443	5	93	97
A-C	-14.9793	13.0243	42.2708	40.3158	61	13	1	3190	3	51	56
B-C	0.0	3.718	-3.5903	0.1277	15	0	1	262	0	11	11
B-D	0.0	0.0	-0.0905	-0.0905	2	0	0	25	0	3	1
C-D	0.0	-102.7218	-274.146	-376.8678	137	8	7	14145	2	94	97

Interface residues

• A-B: ALA272A, ALA272B, ALA324A, ALA324B, ALA394A, ALA394B, ALA405A, ALA405B, ALA409A, ALA409B, ALA410A, ALA410B, ALA412A, ALA412B, ALA417A, ALA417B, ALA421A, ALA421B, ARG332A, ARG332B, ARG380A, ARG380B, ARG400A, ARG400B, ARG413A, ARG413B, ARG418A, ARG418B, ASN278A, ASN278B, ASN279B, ASP338A, ASP338B, ASP345A, ASP345B, ASP407A, ASP407B, ASP411A, ASP411B, GLN320A, GLN320B, GLN334A, GLN334B, GLN346A, GLN346B, GLU236A, GLU236B, GLU331A, GLU331B, GLU353A, GLU353B, GLU396A, GLU396B, GLU397A, GLU397B, GLU428A, GLU428B, GLY273A, GLY273B, GLY398A, GLY398B, GLY403A, GLY403B, GLY424A, GLY424B, HIS275A, HIS275B, HIS318A, HIS318B, HIS349A, HIS349B, HIS427A, HIS427B, ILE274A, ILE274B, ILE336A, ILE336B, ILE341A, ILE341B, ILE425A, ILE425B, ILE429A, ILE429B, LEU325A, LEU325B, LEU339A, LEU339B, LEU399A, LEU399B, LEU402A, LEU402B, LEU416A, LEU416B, LEU419A, LEU419B, LEU420A, LEU420B, LYS234A, LYS234B, LYS277A, LYS277B, LYS327A, LYS327B, LYS340A, LYS340B, LYS342A, LYS342B, LYS408A, LYS408B, LYS415A, LYS415B, LYS423A, LYS423B, MET401A, MET401B, MET406A, MET406B, PRO395A, PRO395B, SER335A, SER335B, THR271A, THR319A, THR319B, THR404A, THR404B, THR414A, THR414B, THR422A, THR422B, THR426A, THR426B, VAL328A, VAL328B, VAL329A, VAL329B, VAL343A, VAL343B
• A-C: ALA186A, ALA191A, ALA199A, ALA224A, ALA453C, ALA70C, ARG102C, ARG187A, ARG65C, ARG92C, ASN165A, ASN89C, ASP100C, ASP140A, ASP219A, ASP230A, ASP231A, ASP433C, ASP67C, ASP87C, GLN204A, GLN240A, GLN334C, GLN441C, GLN456C, GLU103C, GLU139A, GLU190A, GLU197A, GLU438C, GLU449C, GLU64C, GLU71C, GLY193A, GLY200A, GLY232A, ILE192A, ILE459C, LEU105C, LEU69C, LYS194A, LYS198A, LYS226A, LYS244A, LYS437C, LYS439C, LYS452C, LYS455C, LYS460C, MET189A, MET448C, PHE196A, PRO183A, PRO195A, SER435C, SER63C, THR104C, THR436C, THR99C, TYR184A, VAL66C
• B-C: ALA293C, ALA323B, ALA324B, ALA58C, ASP308B, ASP321B, GLN326B, GLN62C, GLU61C, GLU64C, LYS302C, LYS322B, LYS327B, SER60C, SER63C
• B-D: GLN430B, LYS198D
• C-D: ALA272C, ALA272D, ALA324C, ALA324D, ALA394C, ALA394D, ALA405C, ALA405D, ALA409C, ALA409D, ALA410C, ALA410D, ALA412C, ALA412D, ALA417C, ALA417D, ALA421C, ALA421D, ARG332C, ARG332D, ARG380C, ARG380D, ARG400C, ARG400D, ARG413C, ARG413D, ARG418C, ARG418D, ASN278C, ASN278D, ASP338C, ASP338D, ASP345C, ASP345D, ASP407C, ASP407D, ASP411C, ASP411D, GLN320C, GLN320D, GLN334C, GLN334D, GLN346C, GLN346D, GLN430D, GLU236C, GLU236D, GLU331C, GLU331D, GLU353C, GLU353D, GLU396C, GLU396D, GLU397C, GLU397D, GLU428C, GLU428D, GLY273C, GLY273D, GLY398C, GLY398D, GLY403C, GLY403D, GLY424C, GLY424D, HIS275C, HIS275D, HIS318C, HIS318D, HIS349C, HIS349D, HIS427C, HIS427D, ILE274C, ILE274D, ILE336C, ILE336D, ILE341C, ILE341D, ILE425C, ILE425D, ILE429C, ILE429D, LEU325C, LEU325D, LEU339C, LEU339D, LEU399C, LEU399D, LEU402C, LEU402D, LEU416C, LEU416D, LEU419C, LEU419D, LEU420C, LEU420D, LYS234C, LYS234D, LYS277C, LYS277D, LYS327C, LYS327D, LYS340C, LYS340D, LYS342C, LYS342D, LYS408C, LYS408D, LYS415C, LYS415D, LYS423C, LYS423D, MET401C, MET401D, MET406C, MET406D, PRO395C, PRO395D, SER335C, SER335D, THR319C, THR319D, THR404C, THR404D, THR414C, THR414D, THR422C, THR422D, THR426C, THR426D, VAL328C, VAL328D, VAL329C, VAL329D, VAL343C, VAL343D