1OPF

the structure of ompf porin in a tetragonal crystal form

• Total interactions analyzed: 15
• Total true interactions: 9
• Strongest Interaction:
  • Chains: D-E
  • Int. Res.: 140
  • Norm. En. per Res.: -3.8948
• 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	-33.5735	-85.3188	-409.967	-528.8593	140	23	17	16632	4	33	26
A-C	-46.854	-85.4499	-407.952	-540.256	140	27	17	16674	4	33	26
A-D	0.0	0.0	-2.9893	-2.9893	10	0	0	166	0	4	4
A-E	-9.9579	16.682	-51.2493	-44.5252	41	2	0	2351	0	17	19
B-C	-40.962	-85.3181	-409.169	-535.4491	140	21	17	16648	4	33	26
B-D	-8.8101	16.2628	-45.9788	-38.5261	40	1	0	2212	0	15	17
D-E	-50.861	-85.3244	-409.089	-545.2744	140	23	17	16661	4	33	26
D-F	-43.5225	-85.4084	-410.402	-539.3329	140	24	17	16651	4	33	26
E-F	-33.5288	-85.3101	-407.316	-526.155	141	23	17	16659	4	33	26

Interface residues

• A-B: ALA137A, ALA17B, ALA1B, ALA41B, ALA73B, ALA75A, ALA75B, ALA84A, ALA86A, ARG100A, ARG132A, ARG163A, ARG167A, ARG168A, ARG42B, ARG82A, ASN101A, ASN161A, ASN27B, ASN304B, ASN306B, ASN35B, ASN52A, ASN5A, ASN64A, ASN64B, ASN68B, ASN69A, ASN69B, ASN79A, ASN79B, ASN9A, ASP126A, ASP127A, ASP12A, ASP164A, ASP172A, ASP37B, ASP74B, ASP7A, ASP97A, GLN339B, GLN50A, GLN60A, GLN66A, GLN66B, GLN76A, GLN76B, GLU162A, GLU2A, GLU2B, GLU48A, GLU62A, GLU71B, GLY131A, GLY134A, GLY135A, GLY159A, GLY15B, GLY19B, GLY26B, GLY335B, GLY36B, GLY44A, GLY44B, GLY47A, GLY57A, GLY59A, GLY67B, GLY72B, GLY78A, GLY87A, GLY8A, GLY99A, HIS21B, ILE336B, ILE3A, ILE3B, ILE51A, LEU13A, LEU13B, LEU158A, LEU20B, LEU43A, LEU43B, LEU55A, LEU83A, LEU88A, LYS10A, LYS160A, LYS16B, LYS305B, LYS46A, LYS6A, LYS80A, LYS89A, MET307B, MET38B, PHE23B, PHE303B, PHE340B, PHE45A, PHE65A, PHE65B, PHE85A, PHE96A, SER125A, SER169A, SER308B, SER70B, THR165A, THR309B, THR39B, THR49A, THR56A, THR77A, THR77B, THR81A, TRP61A, TRP61B, TYR14B, TYR157A, TYR22B, TYR301B, TYR302B, TYR338B, TYR40B, TYR4A, TYR4B, TYR58A, TYR63A, TYR63B, TYR90A, TYR98A, VAL11A, VAL133A, VAL136A, VAL18B, VAL334B, VAL337B
• A-C: ALA137C, ALA17A, ALA1A, ALA41A, ALA73A, ALA75A, ALA75C, ALA84C, ALA86C, ARG100C, ARG132C, ARG163C, ARG167C, ARG168C, ARG42A, ARG82C, ASN101C, ASN161C, ASN27A, ASN304A, ASN306A, ASN35A, ASN52C, ASN5C, ASN64A, ASN64C, ASN68A, ASN69A, ASN69C, ASN79A, ASN79C, ASN9C, ASP126C, ASP127C, ASP12C, ASP164C, ASP172C, ASP37A, ASP74A, ASP7C, ASP97C, GLN339A, GLN50C, GLN60C, GLN66A, GLN66C, GLN76A, GLN76C, GLU162C, GLU2A, GLU2C, GLU48C, GLU62C, GLU71A, GLY131C, GLY134C, GLY135C, GLY159C, GLY15A, GLY19A, GLY26A, GLY335A, GLY36A, GLY44A, GLY44C, GLY47C, GLY57C, GLY59C, GLY67A, GLY72A, GLY78C, GLY87C, GLY8C, GLY99C, HIS21A, ILE336A, ILE3A, ILE3C, ILE51C, LEU13A, LEU13C, LEU158C, LEU20A, LEU43A, LEU43C, LEU55C, LEU83C, LEU88C, LYS10C, LYS160C, LYS16A, LYS305A, LYS46C, LYS6C, LYS80C, LYS89C, MET307A, MET38A, PHE23A, PHE303A, PHE340A, PHE45C, PHE65A, PHE65C, PHE85C, PHE96C, SER125C, SER169C, SER308A, SER70A, THR165C, THR309A, THR39A, THR49C, THR56C, THR77A, THR77C, THR81C, TRP61A, TRP61C, TYR14A, TYR157C, TYR22A, TYR301A, TYR302A, TYR338A, TYR40A, TYR4A, TYR4C, TYR58C, TYR63A, TYR63C, TYR90C, TYR98C, VAL11C, VAL133C, VAL136C, VAL18A, VAL334A, VAL337A
• A-D: ASN198A, ASN198D, GLU162A, GLU162D, GLU201A, GLU201D, LYS160A, LYS160D, LYS209A, LYS209D
• A-E: ALA202A, ASN207A, ASN242A, ASN252A, ASN27E, ASN30E, ASN322E, ASP282A, ASP288A, ASP319E, ASP321E, ASP329E, GLU201A, GLU284A, GLU29E, GLY208A, GLY26E, GLY285A, GLY287A, GLY28E, GLY325E, ILE286A, LEU205A, LEU324E, LYS209A, LYS243E, LYS253A, LYS25E, LYS281A, LYS323A, LYS323E, PHE244E, PRO204A, SER31E, SER320E, SER328E, THR245A, THR245E, THR247A, VAL283A, VAL326E
• B-C: ALA137B, ALA17C, ALA1C, ALA41C, ALA73C, ALA75B, ALA75C, ALA84B, ALA86B, ARG100B, ARG132B, ARG163B, ARG167B, ARG168B, ARG42C, ARG82B, ASN101B, ASN161B, ASN27C, ASN304C, ASN306C, ASN35C, ASN52B, ASN5B, ASN64B, ASN64C, ASN68C, ASN69B, ASN69C, ASN79B, ASN79C, ASN9B, ASP126B, ASP127B, ASP12B, ASP164B, ASP172B, ASP37C, ASP74C, ASP7B, ASP97B, GLN339C, GLN50B, GLN60B, GLN66B, GLN66C, GLN76B, GLN76C, GLU162B, GLU2B, GLU2C, GLU48B, GLU62B, GLU71C, GLY131B, GLY134B, GLY135B, GLY159B, GLY15C, GLY19C, GLY26C, GLY335C, GLY36C, GLY44B, GLY44C, GLY47B, GLY57B, GLY59B, GLY67C, GLY72C, GLY78B, GLY87B, GLY8B, GLY99B, HIS21C, ILE336C, ILE3B, ILE3C, ILE51B, LEU13B, LEU13C, LEU158B, LEU20C, LEU43B, LEU43C, LEU55B, LEU83B, LEU88B, LYS10B, LYS160B, LYS16C, LYS305C, LYS46B, LYS6B, LYS80B, LYS89B, MET307C, MET38C, PHE23C, PHE303C, PHE340C, PHE45B, PHE65B, PHE65C, PHE85B, PHE96B, SER125B, SER169B, SER308C, SER70C, THR165B, THR309C, THR39C, THR49B, THR56B, THR77B, THR77C, THR81B, TRP61B, TRP61C, TYR14C, TYR157B, TYR22C, TYR301C, TYR302C, TYR338C, TYR40C, TYR4B, TYR4C, TYR58B, TYR63B, TYR63C, TYR90B, TYR98B, VAL11B, VAL133B, VAL136B, VAL18C, VAL334C, VAL337C
• B-D: ALA202D, ASN207D, ASN242D, ASN252D, ASN27B, ASN30B, ASN322B, ASP282D, ASP288D, ASP319B, ASP321B, ASP329B, GLU201D, GLU284D, GLU29B, GLY208D, GLY26B, GLY285D, GLY287D, GLY28B, GLY325B, ILE286D, LEU205D, LEU324B, LYS209D, LYS243B, LYS25B, LYS281D, LYS323B, LYS323D, PHE244B, PRO204D, SER31B, SER320B, SER328B, THR245B, THR245D, THR247D, VAL283D, VAL326B
• D-E: ALA137D, ALA17E, ALA1E, ALA41E, ALA73E, ALA75D, ALA75E, ALA84D, ALA86D, ARG100D, ARG132D, ARG163D, ARG167D, ARG168D, ARG42E, ARG82D, ASN101D, ASN161D, ASN27E, ASN304E, ASN306E, ASN35E, ASN52D, ASN5D, ASN64D, ASN64E, ASN68E, ASN69D, ASN69E, ASN79D, ASN79E, ASN9D, ASP126D, ASP127D, ASP12D, ASP164D, ASP172D, ASP37E, ASP74E, ASP7D, ASP97D, GLN339E, GLN50D, GLN60D, GLN66D, GLN66E, GLN76D, GLN76E, GLU162D, GLU2D, GLU2E, GLU48D, GLU62D, GLU71E, GLY131D, GLY134D, GLY135D, GLY159D, GLY15E, GLY19E, GLY26E, GLY335E, GLY36E, GLY44D, GLY44E, GLY47D, GLY57D, GLY59D, GLY67E, GLY72E, GLY78D, GLY87D, GLY8D, GLY99D, HIS21E, ILE336E, ILE3D, ILE3E, ILE51D, LEU13D, LEU13E, LEU158D, LEU20E, LEU43D, LEU43E, LEU55D, LEU83D, LEU88D, LYS10D, LYS160D, LYS16E, LYS305E, LYS46D, LYS6D, LYS80D, LYS89D, MET307E, MET38E, PHE23E, PHE303E, PHE340E, PHE45D, PHE65D, PHE65E, PHE85D, PHE96D, SER125D, SER169D, SER308E, SER70E, THR165D, THR309E, THR39E, THR49D, THR56D, THR77D, THR77E, THR81D, TRP61D, TRP61E, TYR14E, TYR157D, TYR22E, TYR301E, TYR302E, TYR338E, TYR40E, TYR4D, TYR4E, TYR58D, TYR63D, TYR63E, TYR90D, TYR98D, VAL11D, VAL133D, VAL136D, VAL18E, VAL334E, VAL337E
• D-F: ALA137F, ALA17D, ALA1D, ALA41D, ALA73D, ALA75D, ALA75F, ALA84F, ALA86F, ARG100F, ARG132F, ARG163F, ARG167F, ARG168F, ARG42D, ARG82F, ASN101F, ASN161F, ASN27D, ASN304D, ASN306D, ASN35D, ASN52F, ASN5F, ASN64D, ASN64F, ASN68D, ASN69D, ASN69F, ASN79D, ASN79F, ASN9F, ASP126F, ASP127F, ASP12F, ASP164F, ASP172F, ASP37D, ASP74D, ASP7F, ASP97F, GLN339D, GLN50F, GLN60F, GLN66D, GLN66F, GLN76D, GLN76F, GLU162F, GLU2D, GLU2F, GLU48F, GLU62F, GLU71D, GLY131F, GLY134F, GLY135F, GLY159F, GLY15D, GLY19D, GLY26D, GLY335D, GLY36D, GLY44D, GLY44F, GLY47F, GLY57F, GLY59F, GLY67D, GLY72D, GLY78F, GLY87F, GLY8F, GLY99F, HIS21D, ILE336D, ILE3D, ILE3F, ILE51F, LEU13D, LEU13F, LEU158F, LEU20D, LEU43D, LEU43F, LEU55F, LEU83F, LEU88F, LYS10F, LYS160F, LYS16D, LYS305D, LYS46F, LYS6F, LYS80F, LYS89F, MET307D, MET38D, PHE23D, PHE303D, PHE340D, PHE45F, PHE65D, PHE65F, PHE85F, PHE96F, SER125F, SER169F, SER308D, SER70D, THR165F, THR309D, THR39D, THR49F, THR56F, THR77D, THR77F, THR81F, TRP61D, TRP61F, TYR14D, TYR157F, TYR22D, TYR301D, TYR302D, TYR338D, TYR40D, TYR4D, TYR4F, TYR58F, TYR63D, TYR63F, TYR90F, TYR98F, VAL11F, VAL133F, VAL136F, VAL18D, VAL334D, VAL337D
• E-F: ALA137E, ALA17F, ALA1F, ALA41F, ALA73F, ALA75E, ALA75F, ALA84E, ALA86E, ARG100E, ARG132E, ARG163E, ARG167E, ARG168E, ARG42F, ARG82E, ASN101E, ASN161E, ASN27F, ASN304F, ASN306F, ASN35F, ASN52E, ASN5E, ASN64E, ASN64F, ASN68F, ASN69E, ASN69F, ASN79E, ASN79F, ASN9E, ASP126E, ASP127E, ASP12E, ASP164E, ASP172E, ASP37F, ASP74F, ASP7E, ASP97E, GLN339F, GLN50E, GLN60E, GLN66E, GLN66F, GLN76E, GLN76F, GLU162E, GLU2E, GLU2F, GLU48E, GLU62E, GLU71F, GLY131E, GLY134E, GLY135E, GLY159E, GLY15F, GLY19F, GLY26F, GLY335F, GLY36F, GLY44E, GLY44F, GLY47E, GLY57E, GLY59E, GLY67F, GLY72F, GLY78E, GLY87E, GLY8E, GLY99E, HIS21F, ILE336F, ILE3E, ILE3F, ILE51E, LEU13E, LEU13F, LEU158E, LEU20F, LEU43E, LEU43F, LEU55E, LEU83E, LEU88E, LYS10E, LYS160E, LYS16F, LYS305F, LYS46E, LYS6E, LYS80E, LYS89E, MET307F, MET38F, PHE23F, PHE303F, PHE340F, PHE45E, PHE65E, PHE65F, PHE85E, PHE96E, SER125E, SER169E, SER308F, SER70F, THR165E, THR309F, THR39F, THR49E, THR56E, THR77E, THR77F, THR81E, TRP61E, TRP61F, TYR102E, TYR14F, TYR157E, TYR22F, TYR301F, TYR302F, TYR338F, TYR40F, TYR4E, TYR4F, TYR58E, TYR63E, TYR63F, TYR90E, TYR98E, VAL11E, VAL133E, VAL136E, VAL18F, VAL334F, VAL337F