1PJL

Crystal structure of human m-NAD-ME in ternary complex with NAD and Lu3+

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004470	molecular_function	malic enzyme activity
A	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
A	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
A	0005739	cellular_component	mitochondrion
A	0005759	cellular_component	mitochondrial matrix
A	0008948	molecular_function	oxaloacetate decarboxylase activity
A	0009055	molecular_function	electron transfer activity
A	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
A	0051287	molecular_function	NAD binding
A	1902031	biological_process	regulation of NADP metabolic process
B	0004470	molecular_function	malic enzyme activity
B	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
B	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
B	0005739	cellular_component	mitochondrion
B	0005759	cellular_component	mitochondrial matrix
B	0008948	molecular_function	oxaloacetate decarboxylase activity
B	0009055	molecular_function	electron transfer activity
B	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
B	0051287	molecular_function	NAD binding
B	1902031	biological_process	regulation of NADP metabolic process
C	0004470	molecular_function	malic enzyme activity
C	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
C	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
C	0005739	cellular_component	mitochondrion
C	0005759	cellular_component	mitochondrial matrix
C	0008948	molecular_function	oxaloacetate decarboxylase activity
C	0009055	molecular_function	electron transfer activity
C	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
C	0051287	molecular_function	NAD binding
C	1902031	biological_process	regulation of NADP metabolic process
D	0004470	molecular_function	malic enzyme activity
D	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
D	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
D	0005739	cellular_component	mitochondrion
D	0005759	cellular_component	mitochondrial matrix
D	0008948	molecular_function	oxaloacetate decarboxylase activity
D	0009055	molecular_function	electron transfer activity
D	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
D	0051287	molecular_function	NAD binding
D	1902031	biological_process	regulation of NADP metabolic process
E	0004470	molecular_function	malic enzyme activity
E	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
E	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
E	0005739	cellular_component	mitochondrion
E	0005759	cellular_component	mitochondrial matrix
E	0008948	molecular_function	oxaloacetate decarboxylase activity
E	0009055	molecular_function	electron transfer activity
E	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
E	0051287	molecular_function	NAD binding
E	1902031	biological_process	regulation of NADP metabolic process
F	0004470	molecular_function	malic enzyme activity
F	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
F	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
F	0005739	cellular_component	mitochondrion
F	0005759	cellular_component	mitochondrial matrix
F	0008948	molecular_function	oxaloacetate decarboxylase activity
F	0009055	molecular_function	electron transfer activity
F	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
F	0051287	molecular_function	NAD binding
F	1902031	biological_process	regulation of NADP metabolic process
G	0004470	molecular_function	malic enzyme activity
G	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
G	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
G	0005739	cellular_component	mitochondrion
G	0005759	cellular_component	mitochondrial matrix
G	0008948	molecular_function	oxaloacetate decarboxylase activity
G	0009055	molecular_function	electron transfer activity
G	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
G	0051287	molecular_function	NAD binding
G	1902031	biological_process	regulation of NADP metabolic process
H	0004470	molecular_function	malic enzyme activity
H	0004471	molecular_function	malate dehydrogenase (decarboxylating) (NAD+) activity
H	0004473	molecular_function	malate dehydrogenase (decarboxylating) (NADP+) activity
H	0005739	cellular_component	mitochondrion
H	0005759	cellular_component	mitochondrial matrix
H	0008948	molecular_function	oxaloacetate decarboxylase activity
H	0009055	molecular_function	electron transfer activity
H	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
H	0051287	molecular_function	NAD binding
H	1902031	biological_process	regulation of NADP metabolic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU A 604

Chain	Residue
A	GLU255
A	ASP256
A	ASP279

---

site_id	AC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU B 1604

Chain	Residue
B	GLU1255
B	ASP1256
B	ASP1279

---

site_id	AC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU C 2604

Chain	Residue
C	GLU2255
C	ASP2256
C	ASP2279

---

site_id	AC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU D 3604

Chain	Residue
D	GLU3255
D	ASP3256
D	ASP3279

---

site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU E 4604

Chain	Residue
E	GLU4255
E	ASP4256
E	ASP4279

---

site_id	AC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU F 5604

Chain	Residue
F	GLU5255
F	ASP5256
F	ASP5279

---

site_id	AC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU G 6604

Chain	Residue
G	GLU6255
G	ASP6256
G	ASP6279

---

site_id	AC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE LU H 7604

Chain	Residue
H	GLU7255
H	ASP7256
H	ASP7279

---

site_id	AC9
Number of Residues	21
Details	BINDING SITE FOR RESIDUE NAD A 601

Chain	Residue
A	ARG165
A	ASN259
A	THR283
A	LEU310
A	ALA312
A	GLY313
A	GLU314
A	ALA315
A	ASP345
A	LYS346
A	VAL392
A	ALA393
A	GLY394
A	ALA395
A	LEU398
A	LEU419
A	SER420
A	ASN421
A	GLY446
A	GLY465
A	ASN467

---

site_id	BC1
Number of Residues	10
Details	BINDING SITE FOR RESIDUE NAD A 602

Chain	Residue
A	HIS154
A	GLY192
A	ILE193
A	ARG194
A	ARG197
A	ILE479
A	LEU480
A	ARG542
A	TYR552
A	ARG556

---

site_id	BC2
Number of Residues	20
Details	BINDING SITE FOR RESIDUE NAD B 1601

Chain	Residue
B	ASN1259
B	THR1283
B	LEU1310
B	ALA1312
B	GLY1313
B	GLU1314
B	ALA1315
B	ASP1345
B	LYS1346
B	VAL1392
B	ALA1393
B	GLY1394
B	ALA1395
B	LEU1398
B	LEU1419
B	SER1420
B	ASN1421
B	GLY1465
B	ASN1467
B	HOH8059

---

site_id	BC3
Number of Residues	12
Details	BINDING SITE FOR RESIDUE NAD B 1602

Chain	Residue
B	HIS1154
B	LYS1156
B	GLY1192
B	ILE1193
B	ARG1194
B	ARG1197
B	ILE1479
B	LEU1480
B	ASN1482
B	ARG1542
B	TYR1552
B	ARG1556

---

site_id	BC4
Number of Residues	21
Details	BINDING SITE FOR RESIDUE NAD C 2601

Chain	Residue
C	GLY2394
C	ALA2395
C	LEU2398
C	LEU2419
C	SER2420
C	ASN2421
C	GLY2446
C	GLY2465
C	ASN2467
C	ARG2165
C	ASN2259
C	THR2283
C	LEU2310
C	ALA2312
C	GLY2313
C	GLU2314
C	ALA2315
C	ASP2345
C	LYS2346
C	VAL2392
C	ALA2393

---

site_id	BC5
Number of Residues	11
Details	BINDING SITE FOR RESIDUE NAD C 2602

Chain	Residue
C	HIS2154
C	GLY2192
C	ILE2193
C	ARG2194
C	ARG2197
C	ILE2479
C	LEU2480
C	ASN2482
C	ARG2542
C	TYR2552
C	ARG2556

---

site_id	BC6
Number of Residues	22
Details	BINDING SITE FOR RESIDUE NAD D 3601

Chain	Residue
D	ARG3165
D	ASN3259
D	THR3283
D	LEU3310
D	GLY3311
D	ALA3312
D	GLY3313
D	GLU3314
D	ALA3315
D	ASP3345
D	LYS3346
D	VAL3392
D	ALA3393
D	GLY3394
D	ALA3395
D	LEU3398
D	LEU3419
D	SER3420
D	ASN3421
D	GLY3446
D	GLY3465
D	ASN3467

---

site_id	BC7
Number of Residues	10
Details	BINDING SITE FOR RESIDUE NAD D 3602

Chain	Residue
D	HIS3154
D	LYS3156
D	GLY3192
D	ILE3193
D	ARG3194
D	ILE3479
D	LEU3480
D	ARG3542
D	TYR3552
D	ARG3556

---

site_id	BC8
Number of Residues	23
Details	BINDING SITE FOR RESIDUE NAD E 4601

Chain	Residue
E	ARG4165
E	ASN4259
E	THR4283
E	LEU4310
E	GLY4311
E	ALA4312
E	GLY4313
E	GLU4314
E	ALA4315
E	PHE4344
E	ASP4345
E	LYS4346
E	VAL4392
E	ALA4393
E	GLY4394
E	ALA4395
E	LEU4398
E	LEU4419
E	SER4420
E	ASN4421
E	GLY4446
E	GLY4465
E	ASN4467

---

site_id	BC9
Number of Residues	10
Details	BINDING SITE FOR RESIDUE NAD E 4602

Chain	Residue
E	HIS4154
E	LYS4156
E	GLY4192
E	ILE4193
E	ARG4194
E	ARG4197
E	LEU4480
E	ARG4542
E	TYR4552
E	ARG4556

---

site_id	CC1
Number of Residues	21
Details	BINDING SITE FOR RESIDUE NAD F 5601

Chain	Residue
F	ARG5165
F	ASN5259
F	THR5283
F	LEU5310
F	GLY5311
F	ALA5312
F	GLY5313
F	GLU5314
F	ALA5315
F	ASP5345
F	LYS5346
F	VAL5392
F	ALA5393
F	GLY5394
F	ALA5395
F	LEU5398
F	LEU5419
F	ASN5421
F	GLY5446
F	GLY5465
F	ASN5467

---

site_id	CC2
Number of Residues	8
Details	BINDING SITE FOR RESIDUE NAD F 5602

Chain	Residue
F	GLY5192
F	ILE5193
F	ARG5194
F	ARG5197
F	ILE5479
F	LEU5480
F	ARG5542
F	ARG5556

---

site_id	CC3
Number of Residues	21
Details	BINDING SITE FOR RESIDUE NAD G 6601

Chain	Residue
G	ARG6165
G	ASN6259
G	THR6283
G	LEU6310
G	GLY6311
G	ALA6312
G	GLY6313
G	GLU6314
G	ALA6315
G	ASP6345
G	LYS6346
G	ALA6393
G	GLY6394
G	ALA6395
G	LEU6398
G	LEU6419
G	SER6420
G	ASN6421
G	GLY6446
G	GLY6465
G	ASN6467

---

site_id	CC4
Number of Residues	9
Details	BINDING SITE FOR RESIDUE NAD G 6602

Chain	Residue
G	GLY6192
G	ILE6193
G	ARG6194
G	ARG6197
G	ILE6479
G	LEU6480
G	ARG6542
G	TYR6552
G	ARG6556

---

site_id	CC5
Number of Residues	19
Details	BINDING SITE FOR RESIDUE NAD H 7601

Chain	Residue
H	ARG7165
H	THR7283
H	LEU7310
H	GLY7311
H	ALA7312
H	GLY7313
H	GLU7314
H	ALA7315
H	ASP7345
H	LYS7346
H	VAL7392
H	ALA7393
H	ALA7395
H	LEU7398
H	LEU7419
H	ASN7421
H	GLY7446
H	GLY7465
H	ASN7467

---

site_id	CC6
Number of Residues	8
Details	BINDING SITE FOR RESIDUE NAD H 7602

Chain	Residue
H	ILE7193
H	ARG7194
H	ARG7197
H	ILE7479
H	LEU7480
H	ARG7542
H	TYR7552
H	ARG7556

---

Functional Information from PROSITE/UniProt

site_id	PS00331
Number of Residues	17
Details	MALIC_ENZYMES Malic enzymes signature. FnDDiqGTAaVaLAGLL

Chain	Residue	Details
A	PHE276-LEU292

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	8
Details	Active site: {"description":"Proton donor","evidences":[{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	8
Details	Active site: {"description":"Proton acceptor","evidences":[{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	16
Details	Binding site: {"evidences":[{"source":"PubMed","id":"12121650","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1GZ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GZ4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ4","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	16
Details	Binding site: {"evidences":[{"source":"PubMed","id":"10700286","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1DO8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1QR6","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	24
Details	Binding site: {"evidences":[{"source":"PubMed","id":"10700286","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12121650","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1DO8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GZ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GZ4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ4","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI6
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PubMed","id":"10700286","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1DO8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1QR6","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI7
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PDB","id":"1DO8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1QR6","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI8
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PDB","id":"1DO8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1EFL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1QR6","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI9
Number of Residues	16
Details	Binding site: {"evidences":[{"source":"PubMed","id":"12962632","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1PJ2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1PJ4","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI10
Number of Residues	40
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"19608861","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

Catalytic Information from CSA

site_id	CSA1
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
A	ASP278
A	LYS183
A	TYR112

---

site_id	CSA2
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
B	LYS1183
B	ASP1278
B	TYR1112

---

site_id	CSA3
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
C	ASP2278
C	LYS2183
C	TYR2112

---

site_id	CSA4
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
D	ASP3278
D	TYR3112
D	LYS3183

---

site_id	CSA5
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
E	ASP4278
E	TYR4112
E	LYS4183

---

site_id	CSA6
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
F	TYR5112
F	LYS5183
F	ASP5278

---

site_id	CSA7
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
G	TYR6112
G	LYS6183
G	ASP6278

---

site_id	CSA8
Number of Residues	3
Details	Annotated By Reference To The Literature 1do8

Chain	Residue	Details
H	ASP7278
H	LYS7183
H	TYR7112

---

site_id	MCSA1
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
A	ARG140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
A	ILE193	electrostatic stabiliser, hydrogen bond donor
A	ASP215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
A	GLN295	metal ligand
A	LYS296	metal ligand
A	GLY318	hydrogen bond acceptor, proton acceptor, proton donor
A	ILE319	metal ligand
A	ALA477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA2
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
B	ARG1140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
B	ILE1193	electrostatic stabiliser, hydrogen bond donor
B	ASP1215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
B	GLN1295	metal ligand
B	LYS1296	metal ligand
B	GLY1318	hydrogen bond acceptor, proton acceptor, proton donor
B	ILE1319	metal ligand
B	ALA1477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA3
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
C	ARG2140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
C	ILE2193	electrostatic stabiliser, hydrogen bond donor
C	ASP2215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
C	GLN2295	metal ligand
C	LYS2296	metal ligand
C	GLY2318	hydrogen bond acceptor, proton acceptor, proton donor
C	ILE2319	metal ligand
C	ALA2477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA4
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
D	ARG3140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
D	ILE3193	electrostatic stabiliser, hydrogen bond donor
D	ASP3215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
D	GLN3295	metal ligand
D	LYS3296	metal ligand
D	GLY3318	hydrogen bond acceptor, proton acceptor, proton donor
D	ILE3319	metal ligand
D	ALA3477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA5
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
E	ARG4140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
E	ILE4193	electrostatic stabiliser, hydrogen bond donor
E	ASP4215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
E	GLN4295	metal ligand
E	LYS4296	metal ligand
E	GLY4318	hydrogen bond acceptor, proton acceptor, proton donor
E	ILE4319	metal ligand
E	ALA4477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA6
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
F	ARG5140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
F	ILE5193	electrostatic stabiliser, hydrogen bond donor
F	ASP5215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
F	GLN5295	metal ligand
F	LYS5296	metal ligand
F	GLY5318	hydrogen bond acceptor, proton acceptor, proton donor
F	ILE5319	metal ligand
F	ALA5477	electrostatic stabiliser, hydrogen bond donor

---

site_id	MCSA7
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
G	ARG6140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
G	ILE6193	electrostatic stabiliser, hydrogen bond donor
G	ASP6215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
G	GLN6295	metal ligand
G	LYS6296	metal ligand
G	GLY6318	hydrogen bond acceptor, proton acceptor, proton donor
G	ILE6319	metal ligand
G	ALA6477	electrostatic stabiliser, hydrogen bond donor

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site_id	MCSA8
Number of Residues	8
Details	M-CSA 21

Chain	Residue	Details
H	ARG7140	electrostatic stabiliser, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor
H	ILE7193	electrostatic stabiliser, hydrogen bond donor
H	ASP7215	electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor, proton relay
H	GLN7295	metal ligand
H	LYS7296	metal ligand
H	GLY7318	hydrogen bond acceptor, proton acceptor, proton donor
H	ILE7319	metal ligand
H	ALA7477	electrostatic stabiliser, hydrogen bond donor

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