3KLZ

pentameric formate channel with formate bound

• Total interactions analyzed: 10
• Total true interactions: 10
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 156
  • Norm. En. per Res.: -3.1062
• Hub Node: A(4)

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	-25.4704	-19.6124	-402.084	-447.1669	157	12	15	18619	2	15	11
A-C	0.0	0.0	-0.1465	-0.1465	4	0	0	45	0	1	2
A-D	0.0	0.0	-0.2876	-0.2876	5	0	0	70	0	2	2
A-E	-39.022	21.6098	-458.182	-475.5942	159	13	16	20132	2	15	15
B-C	-42.2786	-19.5886	-422.693	-484.5602	156	9	17	19183	2	15	12
B-D	0.0	0.0	-0.1845	-0.1845	5	0	0	55	0	1	2
B-E	0.0	0.0	-0.1361	-0.1361	5	0	0	44	0	1	2
C-D	-26.8524	-11.886	-429.9	-468.6384	160	12	18	19692	2	16	15
C-E	0.0	0.0	-0.1575	-0.1575	5	0	0	50	0	1	2
D-E	-25.0952	-12.3356	-432.015	-469.4458	161	10	15	19580	2	17	15

Interface residues

• A-B: ALA133B, ALA163A, ALA165A, ALA177A, ALA184A, ALA199A, ALA29B, ALA37B, ALA40B, ALA47B, ALA58B, ALA73B, ARG135B, ARG185A, ARG185B, ASN147B, ASP140B, ASP189A, ASP189B, ASP60A, ASP60B, CYS170A, CYS175A, GLN136B, GLN143B, GLN162A, GLN43B, GLU139B, GLU207A, GLY141B, GLY167A, GLY205A, GLY24B, GLY264A, GLY270A, GLY45B, GLY57B, GLY64A, GLY70B, GLY71A, GLY71B, GLY77B, GLY85B, GLY86B, HIS154A, HIS157A, HIS158A, HIS59B, ILE126B, ILE130B, ILE172A, ILE195A, ILE195B, ILE276A, ILE38B, ILE42B, ILE46B, ILE79B, ILE83B, LEU127B, LEU132B, LEU144B, LEU161A, LEU166A, LEU168A, LEU173A, LEU176A, LEU187A, LEU187B, LEU194A, LEU194B, LEU196A, LEU275A, LEU278A, LEU35B, LEU36B, LEU68A, LEU69A, LEU69B, LEU72A, LEU72B, LEU76B, LEU80B, LYS190A, LYS190B, LYS25B, LYS27B, LYS28B, LYS32B, LYS67A, MET131B, MET138B, MET169A, MET180A, MET192A, MET192B, MET200A, MET271A, MET61A, MET61B, PHE129B, PHE137B, PHE164A, PHE182A, PHE201A, PHE206A, PHE214B, PHE268A, PHE34B, PHE48B, PHE50B, PHE74B, PRO197A, PRO62A, PRO62B, SER183A, SER186A, SER186B, SER203A, SER204A, SER33B, SER39B, SER75B, THR134B, THR159A, THR181A, THR188A, THR188B, THR52B, THR55B, THR56B, THR66A, THR66B, THR84B, TRP179A, TRP272A, TRP274A, TYR273A, TYR277A, TYR31B, TYR51B, TYR63A, VAL191A, VAL191B, VAL193A, VAL193B, VAL198A, VAL202A, VAL263A, VAL267A, VAL49B, VAL53B, VAL54B, VAL65A, VAL65B, VAL81B, VAL82B
• A-C: ASP189A, MET192A, THR188A, THR188C
• A-D: ASP189D, MET192A, MET192D, THR188A, THR188D
• A-E: ALA133A, ALA163E, ALA165E, ALA177E, ALA184A, ALA184E, ALA199E, ALA29A, ALA30A, ALA37A, ALA40A, ALA47A, ALA58A, ALA73A, ARG135A, ARG185A, ARG185E, ASN147A, ASP140A, ASP189A, ASP189E, ASP60A, ASP60E, CYS170E, CYS175E, GLN136A, GLN143A, GLN162E, GLN43A, GLU139A, GLU207E, GLU87A, GLY123A, GLY141A, GLY167E, GLY205E, GLY264E, GLY270E, GLY45A, GLY57A, GLY64E, GLY70A, GLY71A, GLY71E, GLY77A, GLY85A, GLY86A, HIS154E, HIS158E, HIS59A, ILE126A, ILE130A, ILE172E, ILE195A, ILE195E, ILE276E, ILE38A, ILE42A, ILE46A, ILE79A, ILE83A, LEU127A, LEU132A, LEU144A, LEU161E, LEU166E, LEU168E, LEU173E, LEU176E, LEU187A, LEU187E, LEU194A, LEU194E, LEU196E, LEU275E, LEU278E, LEU35A, LEU36A, LEU68E, LEU69A, LEU69E, LEU72A, LEU72E, LEU76A, LEU80A, LYS190A, LYS190E, LYS25A, LYS279E, LYS27A, LYS28A, LYS32A, LYS67E, MET131A, MET138A, MET169E, MET180E, MET192A, MET192E, MET200E, MET271E, MET61A, MET61E, PHE129A, PHE137A, PHE164E, PHE182E, PHE201E, PHE206E, PHE214A, PHE268E, PHE34A, PHE48A, PHE50A, PHE74A, PRO197E, PRO62A, PRO62E, SER183E, SER186A, SER186E, SER203E, SER204E, SER33A, SER39A, SER75A, THR134A, THR159E, THR181E, THR188A, THR188E, THR52A, THR55A, THR56A, THR66A, THR66E, THR84A, TRP179E, TRP272E, TRP274E, TYR273E, TYR277E, TYR31A, TYR51A, TYR63E, VAL191A, VAL191E, VAL193E, VAL198E, VAL202E, VAL263E, VAL267E, VAL49A, VAL53A, VAL54A, VAL65A, VAL65E, VAL81A, VAL82A
• B-C: ALA133C, ALA163B, ALA165B, ALA177B, ALA184B, ALA184C, ALA199B, ALA29C, ALA30C, ALA37C, ALA47C, ALA58C, ALA73C, ARG135C, ARG185B, ARG185C, ASN147C, ASP140C, ASP189B, ASP189C, ASP60B, ASP60C, CYS170B, CYS175B, GLN136C, GLN143C, GLN162B, GLN43C, GLU139C, GLU207B, GLU87C, GLY141C, GLY167B, GLY205B, GLY264B, GLY270B, GLY45C, GLY57C, GLY64B, GLY70C, GLY71B, GLY77C, GLY85C, GLY86C, HIS154B, HIS157B, HIS158B, HIS59C, ILE126C, ILE130C, ILE172B, ILE195B, ILE195C, ILE276B, ILE38C, ILE42C, ILE46C, ILE79C, ILE83C, LEU127C, LEU132C, LEU144C, LEU161B, LEU166B, LEU168B, LEU173B, LEU176B, LEU187B, LEU187C, LEU194B, LEU194C, LEU196B, LEU275B, LEU278B, LEU35C, LEU36C, LEU68B, LEU69B, LEU69C, LEU72B, LEU72C, LEU76C, LEU80C, LYS190B, LYS190C, LYS25C, LYS27C, LYS28C, LYS32C, LYS67B, MET131C, MET138C, MET169B, MET180B, MET192B, MET192C, MET200B, MET271B, MET61B, MET61C, PHE129C, PHE137C, PHE164B, PHE182B, PHE201B, PHE206B, PHE214C, PHE268B, PHE34C, PHE48C, PHE50C, PHE74C, PRO197B, PRO62B, PRO62C, SER183B, SER186B, SER186C, SER203B, SER204B, SER33C, SER39C, SER75C, THR134C, THR159B, THR181B, THR188B, THR188C, THR52C, THR55C, THR56C, THR66B, THR66C, THR84C, TRP179B, TRP272B, TRP274B, TYR273B, TYR277B, TYR31C, TYR51C, TYR63B, VAL191B, VAL191C, VAL193B, VAL193C, VAL198B, VAL202B, VAL267B, VAL49C, VAL53C, VAL54C, VAL65B, VAL65C, VAL81C, VAL82C
• B-D: ASP189B, MET192B, MET192D, THR188B, THR188D
• B-E: ASP189E, MET192B, MET192E, THR188B, THR188E
• C-D: ALA133D, ALA163C, ALA165C, ALA177C, ALA184C, ALA184D, ALA199C, ALA29D, ALA30D, ALA37D, ALA47D, ALA58D, ALA73D, ARG135D, ARG185C, ARG185D, ASN147D, ASP140D, ASP189C, ASP189D, ASP60C, ASP60D, CYS170C, CYS175C, GLN136D, GLN143D, GLN162C, GLN43D, GLU139D, GLU207C, GLU87D, GLY141D, GLY142D, GLY167C, GLY205C, GLY264C, GLY270C, GLY45D, GLY57D, GLY64C, GLY70D, GLY71C, GLY71D, GLY77D, GLY85D, GLY86D, HIS154C, HIS157C, HIS158C, HIS59D, ILE126D, ILE130D, ILE172C, ILE195C, ILE195D, ILE276C, ILE38D, ILE42D, ILE46D, ILE79D, ILE83D, LEU127D, LEU132D, LEU144D, LEU161C, LEU166C, LEU168C, LEU173C, LEU176C, LEU187C, LEU187D, LEU194C, LEU194D, LEU196C, LEU275C, LEU278C, LEU35D, LEU36D, LEU68C, LEU69C, LEU69D, LEU72C, LEU72D, LEU76D, LEU80D, LYS190C, LYS190D, LYS25D, LYS279C, LYS27D, LYS28D, LYS32D, LYS67C, MET131D, MET138D, MET169C, MET180C, MET192C, MET192D, MET200C, MET271C, MET61C, MET61D, PHE129D, PHE137D, PHE164C, PHE182C, PHE201C, PHE206C, PHE214D, PHE268C, PHE34D, PHE48D, PHE50D, PHE74D, PRO197C, PRO62C, PRO62D, SER183C, SER186C, SER186D, SER203C, SER204C, SER33D, SER39D, SER75D, THR134D, THR159C, THR181C, THR188C, THR188D, THR52D, THR55D, THR56D, THR66C, THR66D, THR84D, TRP179C, TRP272C, TRP274C, TYR273C, TYR277C, TYR31D, TYR51D, TYR63C, VAL191C, VAL191D, VAL193C, VAL193D, VAL198C, VAL202C, VAL263C, VAL267C, VAL49D, VAL53D, VAL54D, VAL65C, VAL65D, VAL81D, VAL82D
• C-E: ASP189C, MET192C, MET192E, THR188C, THR188E
• D-E: ALA133E, ALA163D, ALA165D, ALA177D, ALA184D, ALA184E, ALA199D, ALA29E, ALA30E, ALA37E, ALA40E, ALA47E, ALA58E, ALA73E, ARG135E, ARG185D, ARG185E, ASN147E, ASP140E, ASP189D, ASP189E, ASP60D, ASP60E, CYS170D, CYS175D, GLN136E, GLN143E, GLN162D, GLN43E, GLU139E, GLU207D, GLU87E, GLY123E, GLY141E, GLY142E, GLY167D, GLY205D, GLY24E, GLY264D, GLY270D, GLY45E, GLY57E, GLY64D, GLY70E, GLY71D, GLY71E, GLY77E, GLY85E, GLY86E, HIS154D, HIS157D, HIS158D, HIS59E, ILE126E, ILE130E, ILE172D, ILE195D, ILE195E, ILE276D, ILE38E, ILE42E, ILE46E, ILE79E, ILE83E, LEU127E, LEU132E, LEU144E, LEU161D, LEU166D, LEU168D, LEU173D, LEU176D, LEU187D, LEU187E, LEU194D, LEU194E, LEU196D, LEU275D, LEU278D, LEU35E, LEU36E, LEU68D, LEU69D, LEU69E, LEU72D, LEU72E, LEU76E, LEU80E, LYS190D, LYS190E, LYS25E, LYS279D, LYS27E, LYS28E, LYS32E, LYS67D, MET131E, MET138E, MET169D, MET180D, MET192D, MET192E, MET200D, MET271D, MET61D, MET61E, PHE129E, PHE137E, PHE164D, PHE182D, PHE201D, PHE206D, PHE214E, PHE268D, PHE34E, PHE48E, PHE50E, PHE74E, PRO197D, PRO62D, PRO62E, SER183D, SER186D, SER186E, SER203D, SER204D, SER33E, SER39E, SER75E, THR134E, THR159D, THR181D, THR188D, THR188E, THR52E, THR55E, THR56E, THR66D, THR66E, THR84E, TRP179D, TRP272D, TRP274D, TYR273D, TYR277D, TYR31E, TYR51E, TYR63D, VAL191D, VAL191E, VAL193D, VAL198D, VAL202D, VAL267D, VAL49E, VAL53E, VAL54E, VAL65D, VAL65E, VAL81E, VAL82E