3AMD

crystal structures of thermotoga maritima cel5a, apo form and tetramer/au

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 65
  • Norm. En. per Res.: -2.9539
• Hub Node: A(3)

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	0.0	0.0	-1.2014	-1.2014	3	0	0	81	0	2	2
A-C	0.0	6.3215	-51.5223	-45.2008	45	3	0	2955	1	33	40
A-D	-60.203	2.3742	-196.289	-254.1179	93	7	0	7596	2	40	45
B-C	-8.0299	-39.4969	-144.476	-192.0028	65	6	2	5948	3	39	37
B-D	-23.2562	-35.902	-45.4308	-104.5891	39	7	0	2451	1	39	34
C-D	-15.8965	-10.9094	-18.5687	-45.3746	26	1	0	1048	1	26	19

Interface residues

• A-B: ARG71A, LYS229B, PRO225B
• A-C: ALA171C, ALA178C, ARG299A, ARG71A, ARG75A, ASN140C, ASN147C, ASP103C, ASP296A, ASP36A, CYS289A, GLU105C, GLU106C, GLU144C, GLU148C, GLU151C, GLU172C, GLU180C, GLU27A, GLU37A, GLU78A, GLY28A, GLY31A, ILE34A, LEU149C, LEU182C, LEU298A, LYS108C, LYS145C, LYS181C, LYS186C, LYS244C, LYS300A, LYS35A, PHE38A, PRO104C, PRO143C, PRO185C, SER183C, THR142C, THR297A, TRP146C, VAL184C, VAL32A, VAL33A
• A-D: ALA208A, ALA208D, ALA24A, ALA24D, ALA260D, ALA60A, ALA62A, ARG110A, ARG220D, ARG258D, ARG265D, ARG299D, ARG55A, ARG71A, ASN102A, ASN140A, ASN20A, ASN20D, ASN26A, ASN26D, ASP103A, ASP261D, ASP296D, ASP29A, ASP29D, ASP70A, GLN206D, GLU106A, GLU209A, GLU209D, GLU212A, GLU212D, GLU215A, GLU215D, GLU23A, GLU27D, GLU37D, GLU98A, GLU99A, GLY207D, GLY213A, GLY213D, GLY219D, GLY28D, GLY291D, GLY31D, HIS107A, HIS205D, HIS59A, HIS96A, ILE68A, LEU100A, LEU114A, LEU218D, LEU262D, LEU298D, LYS216D, LYS221D, LYS259D, LYS300D, LYS35D, LYS67A, MET101A, MET69A, PHE63A, PHE72A, PHE73A, PRO104A, PRO25A, PRO25D, PRO64A, PRO65A, SER214D, SER290D, SER57A, THR297D, THR301D, THR58A, TRP173A, TRP210A, TRP210D, TRP217D, TRP30A, TRP30D, TRP56A, TYR257A, TYR257D, TYR61A, TYR66A, VAL211A, VAL211D, VAL32D, VAL33D
• B-C: ALA309B, ALA60C, ALA62C, ARG110C, ARG265B, ARG274B, ARG55C, ARG71C, ASN26C, ASN303B, ASP103C, ASP226B, ASP227B, ASP261B, ASP305B, ASP70C, GLN228B, GLU106C, GLU263B, GLU275B, GLU308B, GLU99C, GLY223B, GLY312B, HIS107C, HIS59C, ILE232B, ILE266B, ILE311B, ILE68C, LEU262B, LEU306B, LEU307B, LEU310B, LYS221B, LYS229B, LYS267B, LYS278B, LYS304B, LYS67C, LYS74C, MET69C, PHE271B, PHE63C, PHE72C, PHE73C, PRO225B, PRO25C, PRO64C, PRO65C, SER224B, SER264B, SER270B, SER57C, THR269B, THR58C, TRP222B, TRP268B, TRP302B, TRP56C, TYR61C, TYR66C, TYR97C, VAL272B, VAL273B
• B-D: ARG220B, ARG220D, ASN236D, ASP226B, ASP226D, ASP227B, ASP227D, GLN206B, GLN206D, GLU202B, GLU202D, GLU215B, GLU215D, GLU233B, GLU233D, GLY219B, GLY219D, HIS230B, HIS230D, LEU218B, LEU218D, LYS216B, LYS216D, LYS221B, LYS221D, LYS229B, LYS229D, PHE203B, PHE203D, PRO200D, PRO225B, PRO225D, SER214B, SER224B, SER224D, SER264B, TRP217B, TRP217D, TRP222B
• C-D: ARG220D, ARG265D, ASN102C, ASN140C, ASP103C, ASP261D, ASP305D, GLU106C, GLU212C, GLU263D, GLU308D, GLU98C, GLU99C, GLY139C, GLY219D, HIS107C, HIS138C, LEU218D, LEU262D, LYS221D, LYS267D, MET101C, PRO104C, SER264D, TRP173C, TRP222D