2QSS

bovine hemoglobin at ph 6.3

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 90
  • Norm. En. per Res.: -2.958
• 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	-22.6594	9.9861	-253.55	-266.2233	90	5	12	10025	0	16	19
A-C	-4.9832	-23.5965	-35.0739	-63.6536	37	3	0	1790	1	6	7
A-D	-8.5198	14.7349	-139.866	-133.6509	56	3	0	4881	0	17	15
B-C	-3.2297	17.729	-119.232	-104.7327	58	1	0	4548	0	17	13
B-D	0.0	3.6862	-18.339	-14.6528	28	1	0	854	0	8	21
C-D	-24.6944	10.5844	-250.011	-264.121	90	8	11	9885	0	16	19

Interface residues

• A-B: ALA110A, ALA114B, ALA120A, ALA123A, ALA127B, ALA130A, ALA134B, ALA26A, ALA26B, ALA28A, ALA50B, ARG115B, ARG29B, ARG31A, ASN107B, ASN116B, ASN55B, ASP116A, ASP126A, ASP128B, ASP51B, GLN126B, GLN130B, GLU100B, GLU120B, GLU25B, GLU27A, GLU30A, GLY106B, GLY118B, GLY28B, HIS103A, HIS112A, HIS122A, HIS50A, LEU100A, LEU104B, LEU105A, LEU106A, LEU109A, LEU109B, LEU113A, LEU113B, LEU125A, LEU125B, LEU29A, LEU30B, LEU31B, LEU34A, LYS103B, LYS119B, LYS127A, LYS131B, LYS99A, MET32A, MET54B, PHE117A, PHE117B, PHE121B, PHE129B, PHE33A, PHE36A, PRO114A, PRO119A, PRO123B, PRO35B, PRO37A, SER102A, SER104A, SER111A, SER115A, SER124A, SER35A, THR108A, THR118A, THR122B, TRP36B, TYR34B, VAL107A, VAL108B, VAL110B, VAL111B, VAL112B, VAL121A, VAL124B, VAL133B, VAL32B, VAL33B, VAL53B, VAL96A
• A-C: ALA123A, ALA123C, ALA4C, ALA5C, ARG141A, ARG141C, ASN131A, ASN131C, ASP6A, ASP6C, LEU2A, LEU2C, LYS127A, LYS127C, LYS139A, LYS139C, LYS7C, LYS99A, LYS99C, PHE128C, PRO77A, PRO77C, SER124C, SER138A, SER138C, SER3A, SER3C, THR134A, THR134C, THR137A, THR137C, TYR140A, TYR140C, VAL135A, VAL135C, VAL1A, VAL1C
• A-D: ALA50D, ALA88A, ARG141A, ARG39D, ARG92A, ASN101D, ASN97A, ASP93D, ASP94A, ASP98D, CYS92D, GLN38D, GLU100D, GLU42D, HIS87A, HIS89A, HIS91D, HIS96D, LEU100A, LEU104D, LEU31D, LEU47D, LEU91A, LEU95D, LYS139A, LYS40A, LYS90A, LYS94D, LYS99A, PHE36A, PHE40D, PHE41D, PHE43A, PHE98A, PRO35D, PRO37A, PRO44A, PRO95A, PRO99D, SER48D, THR137A, THR37D, THR38A, THR39A, THR41A, THR49D, TRP36D, TYR140A, TYR144D, TYR34D, TYR42A, VAL32D, VAL33D, VAL93A, VAL96A, VAL97D
• B-C: ALA50B, ALA88C, ARG141C, ARG39B, ARG92C, ASN101B, ASN97C, ASP93B, ASP94C, ASP98B, CYS92B, GLN38B, GLU100B, GLU42B, HIS45C, HIS87C, HIS89C, HIS91B, HIS96B, LEU100C, LEU104B, LEU31B, LEU47B, LEU91C, LEU95B, LYS139C, LYS40C, LYS90C, LYS94B, LYS99C, PHE36C, PHE40B, PHE41B, PHE43C, PHE98C, PRO35B, PRO37C, PRO44C, PRO95C, PRO99B, SER48B, THR137C, THR37B, THR38C, THR39C, THR41C, THR49B, TRP36B, TYR140C, TYR144B, TYR34B, TYR42C, VAL32B, VAL33B, VAL53B, VAL93C, VAL96C, VAL97B
• B-D: ALA134B, ALA134D, ALA139B, ALA141B, ALA141D, ARG143B, ASN138B, ASN138D, ASP98B, GLU100B, GLU100D, GLY135B, GLY135D, HIS142B, HIS142D, HIS145B, HIS145D, LEU80D, LYS103B, LYS103D, LYS131B, LYS81B, LYS81D, MET1B, MET1D, PRO99B, TYR144B, TYR144D
• C-D: ALA110C, ALA114D, ALA120C, ALA123C, ALA127D, ALA130C, ALA134D, ALA26C, ALA26D, ALA28C, ALA50D, ARG115D, ARG29D, ARG31C, ASN107D, ASN116D, ASN55D, ASP116C, ASP126C, ASP128D, ASP51D, GLN126D, GLN130D, GLU100D, GLU120D, GLU25D, GLU27C, GLU30C, GLY106D, GLY118D, GLY28D, HIS103C, HIS112C, HIS122C, HIS50C, LEU100C, LEU104D, LEU105C, LEU105D, LEU106C, LEU109C, LEU109D, LEU113C, LEU113D, LEU125C, LEU125D, LEU29C, LEU30D, LEU31D, LEU34C, LYS103D, LYS119D, LYS127C, LYS131D, LYS99C, MET32C, MET54D, PHE117C, PHE117D, PHE121D, PHE129D, PHE33C, PHE36C, PRO114C, PRO119C, PRO123D, PRO35D, PRO37C, SER102C, SER104C, SER111C, SER115C, SER124C, SER35C, THR108C, THR118C, THR122D, TRP36D, TYR34D, VAL107C, VAL108D, VAL110D, VAL111D, VAL112D, VAL121C, VAL124D, VAL133D, VAL32D, VAL33D, VAL53D