2026-05-16_00000359
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ligand
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9US7
Crystal Structure of Hemophore HphA from A. baumannii with Cobalt Phthalocyanine;
X-ray diffraction 1.41Å
Protein #1
246 residues (99% resolved)
Raw Sequence ...
GSMGIDGISSNESNIKIGAAANASHPGGVAAVSVQAAGAPYNAFTGFSSLKGLAQAFAAQGTSNTNVTVGSKTFNISHIPVSAMPPSHSALGNFNFGQVGTQEVYFGEWWKAGDTPASASHTVYYAGDNTNTTVPTAGTATYTVAGINGSGSNLLSGTFTANYGAGTLEGTLTGTGTAVSSLSLDGVAFNPGTAAFAGLATANGTAGIDNSGVVQGQFFGANASALAGIAQFDNVSYNTAFGGAKN
Canonical Sequence ...
GSMGIDGISSNESNIKIGAAANASHPGGVAAVSVQAAGAPYNAFTGFSSLKGLAQAFAAQGTSNTNVTVGSKTFNISHIPVSAMPPSHSALGNFNFGQVGTQEVYFGEWWKAGDTPASASHTVYYAGDNTNTTVPTAGTATYTVAGINGSGSNLLSGTFTANYGAGTLEGTLTGTGTAVSSLSLDGVAFNPGTAAFAGLATANGTAGIDNSGVVQGQFFGANASALAGIAQFDNVSYNTAFGGAKN
Non polymer #2
A1L9L
InChI=1S/C32H16N8.Co/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2
InChI=1S/C32H16N8.Co/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2
SMILES: c1cc2c/3n4c(c2cc1)/nc/5\nc(/nc/6\n(/c(n\c-7n/c(n3)/c8c7cccc8)/c9c6cccc9)[Co]4)-c1c5cccc1
c1cc2c/3n4c(c2cc1)/nc/5\nc(/nc/6\n(/c(n\c-7n/c(n3)/c8c7cccc8)/c9c6cccc9)[Co]4)-c1c5cccc1
Biounit #1
monomer
Download coordinates
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Model
Reference
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